4-[[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]methyl]-7,8-dimethyl-chromen-2-one

Systemtic Name: 4-[[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]methyl]-7,8-dimethyl-chromen-2-one Openeye Name: 4-[[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]methyl]-7,8-dimethyl-chromen-2-one CAS Name: 4-[[4-(4-methoxyphenyl)sulfonyl-1-piperazinyl]methyl]-7,8-dimethyl-1-benzopyran-2-one IUPAC Name: 4-[[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]methyl]-7,8-dimethylchromen-2-one Traditional Name: 4-[[4-(4-methoxyphenyl)sulfonylpiperazino]methyl]-7,8-dimethyl-coumarin Formula: C23H26N2O5S MolecularWeight: 442.52794

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C(=CC(=O)O2)CN3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)OC)C

Isomeric SMILES

CC1=C(C2=C(C=C1)C(=CC(=O)O2)CN3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)OC)C

InChI

InChI=1S/C23H26N2O5S/c1-16-4-9-21-18(14-22(26)30-23(21)17(16)2)15-24-10-12-25(13-11-24)31(27,28)20-7-5-19(29-3)6-8-20/h4-9,14H,10-13,15H2,1-3H3