[2-(4-chlorophenyl)-6,7-dimethyl-4-oxidanylidene-chromen-3-yl] 4-(phenylsulfonylamino)butanoate

Systemtic Name: [2-(4-chlorophenyl)-6,7-dimethyl-4-oxidanylidene-chromen-3-yl] 4-(phenylsulfonylamino)butanoate Openeye Name: [2-(4-chlorophenyl)-6,7-dimethyl-4-oxo-chromen-3-yl] 4-(benzenesulfonamido)butanoate CAS Name: 4-(benzenesulfonamido)butanoic acid [2-(4-chlorophenyl)-6,7-dimethyl-4-oxo-1-benzopyran-3-yl] ester IUPAC Name: [2-(4-chlorophenyl)-6,7-dimethyl-4-oxochromen-3-yl] 4-(benzenesulfonamido)butanoate Traditional Name: 4-(benzenesulfonamido)butyric acid [2-(4-chlorophenyl)-4-keto-6,7-dimethyl-chromen-3-yl] ester Formula: C27H24ClNO6S MolecularWeight: 526.00056

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=O)C(=C(O2)C3=CC=C(C=C3)Cl)OC(=O)CCCNS(=O)(=O)C4=CC=CC=C4)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=O)C(=C(O2)C3=CC=C(C=C3)Cl)OC(=O)CCCNS(=O)(=O)C4=CC=CC=C4)C

InChI

InChI=1S/C27H24ClNO6S/c1-17-15-22-23(16-18(17)2)34-26(19-10-12-20(28)13-11-19)27(25(22)31)35-24(30)9-6-14-29-36(32,33)21-7-4-3-5-8-21/h3-5,7-8,10-13,15-16,29H,6,9,14H2,1-2H3