3-[4-(3-chlorophenyl)sulfonylpiperazin-1-yl]carbonyl-7-methoxy-1H-quinolin-4-one

Systemtic Name: 3-[4-(3-chlorophenyl)sulfonylpiperazin-1-yl]carbonyl-7-methoxy-1H-quinolin-4-one Openeye Name: 3-[4-(3-chlorophenyl)sulfonylpiperazine-1-carbonyl]-7-methoxy-1H-quinolin-4-one CAS Name: 3-[[4-(3-chlorophenyl)sulfonyl-1-piperazinyl]-oxomethyl]-7-methoxy-1H-quinolin-4-one IUPAC Name: 3-[4-(3-chlorophenyl)sulfonylpiperazine-1-carbonyl]-7-methoxy-1H-quinolin-4-one Traditional Name: 3-[4-(3-chlorophenyl)sulfonylpiperazine-1-carbonyl]-7-methoxy-4-quinolone Formula: C21H20ClN3O5S MolecularWeight: 461.9186

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=O)C(=CN2)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC(=CC=C4)Cl

Isomeric SMILES

COC1=CC2=C(C=C1)C(=O)C(=CN2)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C21H20ClN3O5S/c1-30-15-5-6-17-19(12-15)23-13-18(20(17)26)21(27)24-7-9-25(10-8-24)31(28,29)16-4-2-3-14(22)11-16/h2-6,11-13H,7-10H2,1H3,(H,23,26)