4-[(4-methylsulfonylphenyl)methylcarbamoyl]-4-phenyl-piperidine-1-carboxylic acid

Systemtic Name: 4-[(4-methylsulfonylphenyl)methylcarbamoyl]-4-phenyl-piperidine-1-carboxylic acid Openeye Name: 4-[(4-methylsulfonylphenyl)methylcarbamoyl]-4-phenyl-piperidine-1-carboxylic acid CAS Name: 4-[[(4-methylsulfonylphenyl)methylamino]-oxomethyl]-4-phenyl-1-piperidinecarboxylic acid IUPAC Name: 4-[(4-methylsulfonylphenyl)methylcarbamoyl]-4-phenylpiperidine-1-carboxylic acid Traditional Name: 4-[(4-mesylbenzyl)carbamoyl]-4-phenyl-piperidine-1-carboxylic acid Formula: C21H24N2O5S MolecularWeight: 416.49066

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)CNC(=O)C2(CCN(CC2)C(=O)O)C3=CC=CC=C3

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)CNC(=O)C2(CCN(CC2)C(=O)O)C3=CC=CC=C3

InChI

InChI=1S/C21H24N2O5S/c1-29(27,28)18-9-7-16(8-10-18)15-22-19(24)21(17-5-3-2-4-6-17)11-13-23(14-12-21)20(25)26/h2-10H,11-15H2,1H3,(H,22,24)(H,25,26)