N-(3-chlorophenyl)-6-(4-chlorophenyl)carbonyl-2-oxidanylidene-1H-quinoline-4-carboxamide hydrate

Systemtic Name: N-(3-chlorophenyl)-6-(4-chlorophenyl)carbonyl-2-oxidanylidene-1H-quinoline-4-carboxamide hydrate Openeye Name: 6-(4-chlorobenzoyl)-N-(3-chlorophenyl)-2-oxo-1H-quinoline-4-carboxamide hydrate CAS Name: N-(3-chlorophenyl)-6-[(4-chlorophenyl)-oxomethyl]-2-oxo-1H-quinoline-4-carboxamide hydrate IUPAC Name: 6-(4-chlorobenzoyl)-N-(3-chlorophenyl)-2-oxo-1H-quinoline-4-carboxamide hydrate Traditional Name: 6-(4-chlorobenzoyl)-N-(3-chlorophenyl)-2-keto-1H-quinoline-4-carboxamide hydrate Formula: C23H16Cl2N2O4 MolecularWeight: 455.29014

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)NC(=O)C2=CC(=O)NC3=C2C=C(C=C3)C(=O)C4=CC=C(C=C4)Cl.O

Isomeric SMILES

C1=CC(=CC(=C1)Cl)NC(=O)C2=CC(=O)NC3=C2C=C(C=C3)C(=O)C4=CC=C(C=C4)Cl.O

InChI

InChI=1S/C23H14Cl2N2O3.H2O/c24-15-7-4-13(5-8-15)22(29)14-6-9-20-18(10-14)19(12-21(28)27-20)23(30)26-17-3-1-2-16(25)11-17;/h1-12H,(H,26,30)(H,27,28);1H2