2-[4-[4-[(7-oxidanyl-4-oxidanylidene-3-phenyl-chromen-8-yl)methyl]piperazin-1-yl]sulfonylphenyl]isoindole-1,3-dione

Systemtic Name: 2-[4-[4-[(7-oxidanyl-4-oxidanylidene-3-phenyl-chromen-8-yl)methyl]piperazin-1-yl]sulfonylphenyl]isoindole-1,3-dione Openeye Name: 2-[4-[4-[(7-hydroxy-4-oxo-3-phenyl-chromen-8-yl)methyl]piperazin-1-yl]sulfonylphenyl]isoindoline-1,3-dione CAS Name: 2-[4-[[4-[(7-hydroxy-4-oxo-3-phenyl-1-benzopyran-8-yl)methyl]-1-piperazinyl]sulfonyl]phenyl]isoindole-1,3-dione IUPAC Name: 2-[4-[4-[(7-hydroxy-4-oxo-3-phenylchromen-8-yl)methyl]piperazin-1-yl]sulfonylphenyl]isoindole-1,3-dione Traditional Name: 2-[4-[4-[(7-hydroxy-4-keto-3-phenyl-chromen-8-yl)methyl]piperazino]sulfonylphenyl]isoindoline-1,3-quinone Formula: C34H27N3O7S MolecularWeight: 621.65908

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=C(C=CC3=C2OC=C(C3=O)C4=CC=CC=C4)O)S(=O)(=O)C5=CC=C(C=C5)N6C(=O)C7=CC=CC=C7C6=O

Isomeric SMILES

C1CN(CCN1CC2=C(C=CC3=C2OC=C(C3=O)C4=CC=CC=C4)O)S(=O)(=O)C5=CC=C(C=C5)N6C(=O)C7=CC=CC=C7C6=O

InChI

InChI=1S/C34H27N3O7S/c38-30-15-14-27-31(39)29(22-6-2-1-3-7-22)21-44-32(27)28(30)20-35-16-18-36(19-17-35)45(42,43)24-12-10-23(11-13-24)37-33(40)25-8-4-5-9-26(25)34(37)41/h1-15,21,38H,16-20H2