Chemical Descriptors |
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Type | Program | Version | Descriptor |
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SMILES | ACDLabs | 12.01 | Clc1ccc(CNC(=O)c2ccc(cc2)N2C(=O)CC(C)C2=O)c(Cl)c1 |
SMILES | CACTVS | 3.385 | C[CH]1CC(=O)N(C1=O)c2ccc(cc2)C(=O)NCc3ccc(Cl)cc3Cl |
SMILES | OpenEye OEToolkits | 2.0.7 | CC1CC(=O)N(C1=O)c2ccc(cc2)C(=O)NCc3ccc(cc3Cl)Cl |
Canonical SMILES | CACTVS | 3.385 | C[C@@H]1CC(=O)N(C1=O)c2ccc(cc2)C(=O)NCc3ccc(Cl)cc3Cl |
Canonical SMILES | OpenEye OEToolkits | 2.0.7 | C[C@@H]1CC(=O)N(C1=O)c2ccc(cc2)C(=O)NCc3ccc(cc3Cl)Cl |
InChI | InChI | 1.06 | InChI=1S/C19H16Cl2N2O3/c1-11-8-17(24)23(19(11)26)15-6-3-12(4-7-15)18(25)22-10-13-2-5-14(20)9-16(13)21/h2-7,9,11H,8,10H2,1H3,(H,22,25)/t11-/m1/s1 |
InChIKey | InChI | 1.06 | XQJYUMZZHNFDCF-LLVKDONJSA-N |