[2-oxidanylidene-2-(1H-pyrrol-2-yl)ethyl] 3-[4-(3-chlorophenyl)piperazin-1-yl]sulfonyl-4-methoxy-benzoate

Systemtic Name: [2-oxidanylidene-2-(1H-pyrrol-2-yl)ethyl] 3-[4-(3-chlorophenyl)piperazin-1-yl]sulfonyl-4-methoxy-benzoate Openeye Name: [2-oxo-2-(1H-pyrrol-2-yl)ethyl] 3-[4-(3-chlorophenyl)piperazin-1-yl]sulfonyl-4-methoxy-benzoate CAS Name: 3-[[4-(3-chlorophenyl)-1-piperazinyl]sulfonyl]-4-methoxybenzoic acid [2-oxo-2-(1H-pyrrol-2-yl)ethyl] ester IUPAC Name: [2-oxo-2-(1H-pyrrol-2-yl)ethyl] 3-[4-(3-chlorophenyl)piperazin-1-yl]sulfonyl-4-methoxybenzoate Traditional Name: 3-[4-(3-chlorophenyl)piperazino]sulfonyl-4-methoxy-benzoic acid [2-keto-2-(1H-pyrrol-2-yl)ethyl] ester Formula: C24H24ClN3O6S MolecularWeight: 517.98186

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)OCC(=O)C2=CC=CN2)S(=O)(=O)N3CCN(CC3)C4=CC(=CC=C4)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)OCC(=O)C2=CC=CN2)S(=O)(=O)N3CCN(CC3)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C24H24ClN3O6S/c1-33-22-8-7-17(24(30)34-16-21(29)20-6-3-9-26-20)14-23(22)35(31,32)28-12-10-27(11-13-28)19-5-2-4-18(25)15-19/h2-9,14-15,26H,10-13,16H2,1H3