[2-(4-methoxyphenyl)-6,7-dimethyl-4-oxidanylidene-chromen-3-yl] 4-(4-methylpiperazin-1-yl)sulfonylbenzoate

Systemtic Name: [2-(4-methoxyphenyl)-6,7-dimethyl-4-oxidanylidene-chromen-3-yl] 4-(4-methylpiperazin-1-yl)sulfonylbenzoate Openeye Name: [2-(4-methoxyphenyl)-6,7-dimethyl-4-oxo-chromen-3-yl] 4-(4-methylpiperazin-1-yl)sulfonylbenzoate CAS Name: 4-[(4-methyl-1-piperazinyl)sulfonyl]benzoic acid [2-(4-methoxyphenyl)-6,7-dimethyl-4-oxo-1-benzopyran-3-yl] ester IUPAC Name: [2-(4-methoxyphenyl)-6,7-dimethyl-4-oxochromen-3-yl] 4-(4-methylpiperazin-1-yl)sulfonylbenzoate Traditional Name: 4-(4-methylpiperazino)sulfonylbenzoic acid [4-keto-2-(4-methoxyphenyl)-6,7-dimethyl-chromen-3-yl] ester Formula: C30H30N2O7S MolecularWeight: 562.6334

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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)OC)OC(=O)C4=CC=C(C=C4)S(=O)(=O)N5CCN(CC5)C)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=O)C(=C(O2)C3=CC=C(C=C3)OC)OC(=O)C4=CC=C(C=C4)S(=O)(=O)N5CCN(CC5)C)C

InChI

InChI=1S/C30H30N2O7S/c1-19-17-25-26(18-20(19)2)38-28(21-5-9-23(37-4)10-6-21)29(27(25)33)39-30(34)22-7-11-24(12-8-22)40(35,36)32-15-13-31(3)14-16-32/h5-12,17-18H,13-16H2,1-4H3