4-[6-[4-(3-chlorophenyl)piperazin-1-yl]sulfonyl-3,4-dihydro-2H-quinolin-1-yl]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[6-[4-(3-chlorophenyl)piperazin-1-yl]sulfonyl-3,4-dihydro-2H-quinolin-1-yl]-4-oxidanylidene-butanoic acid Openeye Name: 4-[6-[4-(3-chlorophenyl)piperazin-1-yl]sulfonyl-3,4-dihydro-2H-quinolin-1-yl]-4-oxo-butanoic acid CAS Name: 4-[6-[[4-(3-chlorophenyl)-1-piperazinyl]sulfonyl]-3,4-dihydro-2H-quinolin-1-yl]-4-oxobutanoic acid IUPAC Name: 4-[6-[4-(3-chlorophenyl)piperazin-1-yl]sulfonyl-3,4-dihydro-2H-quinolin-1-yl]-4-oxobutanoic acid Traditional Name: 4-[6-[4-(3-chlorophenyl)piperazino]sulfonyl-3,4-dihydro-2H-quinolin-1-yl]-4-keto-butyric acid Formula: C23H26ClN3O5S MolecularWeight: 491.98764

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=CC(=C2)S(=O)(=O)N3CCN(CC3)C4=CC(=CC=C4)Cl)N(C1)C(=O)CCC(=O)O

Isomeric SMILES

C1CC2=C(C=CC(=C2)S(=O)(=O)N3CCN(CC3)C4=CC(=CC=C4)Cl)N(C1)C(=O)CCC(=O)O

InChI

InChI=1S/C23H26ClN3O5S/c24-18-4-1-5-19(16-18)25-11-13-26(14-12-25)33(31,32)20-6-7-21-17(15-20)3-2-10-27(21)22(28)8-9-23(29)30/h1,4-7,15-16H,2-3,8-14H2,(H,29,30)