methyl 4-[[1-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperidin-4-yl]carbonylamino]benzoate

Systemtic Name: methyl 4-[[1-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperidin-4-yl]carbonylamino]benzoate Openeye Name: methyl 4-[(1-indan-5-ylsulfonylpiperidine-4-carbonyl)amino]benzoate CAS Name: 4-[[[1-(2,3-dihydro-1H-inden-5-ylsulfonyl)-4-piperidinyl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[1-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperidine-4-carbonyl]amino]benzoate Traditional Name: 4-[(1-indan-5-ylsulfonylisonipecotoyl)amino]benzoic acid methyl ester Formula: C23H26N2O5S MolecularWeight: 442.52794

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC4=C(CCC4)C=C3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC4=C(CCC4)C=C3

InChI

InChI=1S/C23H26N2O5S/c1-30-23(27)18-5-8-20(9-6-18)24-22(26)17-11-13-25(14-12-17)31(28,29)21-10-7-16-3-2-4-19(16)15-21/h5-10,15,17H,2-4,11-14H2,1H3,(H,24,26)