(4-phenylphenyl)methyl 1-(1-methylpyrrol-3-yl)sulfonylpiperidine-4-carboxylate

Systemtic Name: (4-phenylphenyl)methyl 1-(1-methylpyrrol-3-yl)sulfonylpiperidine-4-carboxylate Openeye Name: (4-phenylphenyl)methyl 1-(1-methylpyrrol-3-yl)sulfonylpiperidine-4-carboxylate CAS Name: 1-[(1-methyl-3-pyrrolyl)sulfonyl]-4-piperidinecarboxylic acid (4-phenylphenyl)methyl ester IUPAC Name: (4-phenylphenyl)methyl 1-(1-methylpyrrol-3-yl)sulfonylpiperidine-4-carboxylate Traditional Name: 1-(1-methylpyrrol-3-yl)sulfonylisonipecotic acid (4-phenylbenzyl) ester Formula: C24H26N2O4S MolecularWeight: 438.53924

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC(=C1)S(=O)(=O)N2CCC(CC2)C(=O)OCC3=CC=C(C=C3)C4=CC=CC=C4

Isomeric SMILES

CN1C=CC(=C1)S(=O)(=O)N2CCC(CC2)C(=O)OCC3=CC=C(C=C3)C4=CC=CC=C4

InChI

InChI=1S/C24H26N2O4S/c1-25-14-13-23(17-25)31(28,29)26-15-11-22(12-16-26)24(27)30-18-19-7-9-21(10-8-19)20-5-3-2-4-6-20/h2-10,13-14,17,22H,11-12,15-16,18H2,1H3