methyl 2-[4-[2-(2,3-dihydroindol-1-yl)propylcarbamoyl]piperidin-1-yl]sulfonylbenzoate

Systemtic Name: methyl 2-[4-[2-(2,3-dihydroindol-1-yl)propylcarbamoyl]piperidin-1-yl]sulfonylbenzoate Openeye Name: methyl 2-[[4-(2-indolin-1-ylpropylcarbamoyl)-1-piperidyl]sulfonyl]benzoate CAS Name: 2-[[4-[[2-(2,3-dihydroindol-1-yl)propylamino]-oxomethyl]-1-piperidinyl]sulfonyl]benzoic acid methyl ester IUPAC Name: methyl 2-[4-[2-(2,3-dihydroindol-1-yl)propylcarbamoyl]piperidin-1-yl]sulfonylbenzoate Traditional Name: 2-[4-(2-indolin-1-ylpropylcarbamoyl)piperidino]sulfonylbenzoic acid methyl ester Formula: C25H31N3O5S MolecularWeight: 485.59574

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=CC=C2C(=O)OC)N3CCC4=CC=CC=C43

Isomeric SMILES

CC(CNC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=CC=C2C(=O)OC)N3CCC4=CC=CC=C43

InChI

InChI=1S/C25H31N3O5S/c1-18(28-16-13-19-7-3-5-9-22(19)28)17-26-24(29)20-11-14-27(15-12-20)34(31,32)23-10-6-4-8-21(23)25(30)33-2/h3-10,18,20H,11-17H2,1-2H3,(H,26,29)