4-[1-(4-methoxyphenyl)sulfonyl-2-(phenylmethoxycarbamoyl)piperidin-4-yl]carbonylpiperazine-1-carboxylic acid

Systemtic Name: 4-[1-(4-methoxyphenyl)sulfonyl-2-(phenylmethoxycarbamoyl)piperidin-4-yl]carbonylpiperazine-1-carboxylic acid Openeye Name: 4-[2-(benzyloxycarbamoyl)-1-(4-methoxyphenyl)sulfonyl-piperidine-4-carbonyl]piperazine-1-carboxylic acid CAS Name: 4-[[1-(4-methoxyphenyl)sulfonyl-2-[oxo-(phenylmethoxyamino)methyl]-4-piperidinyl]-oxomethyl]-1-piperazinecarboxylic acid IUPAC Name: 4-[1-(4-methoxyphenyl)sulfonyl-2-(phenylmethoxycarbamoyl)piperidine-4-carbonyl]piperazine-1-carboxylic acid Traditional Name: 4-[2-(benzoxycarbamoyl)-1-(4-methoxyphenyl)sulfonyl-isonipecotoyl]piperazine-1-carboxylic acid Formula: C26H32N4O8S MolecularWeight: 560.61928

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2C(=O)NOCC3=CC=CC=C3)C(=O)N4CCN(CC4)C(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2C(=O)NOCC3=CC=CC=C3)C(=O)N4CCN(CC4)C(=O)O

InChI

InChI=1S/C26H32N4O8S/c1-37-21-7-9-22(10-8-21)39(35,36)30-12-11-20(25(32)28-13-15-29(16-14-28)26(33)34)17-23(30)24(31)27-38-18-19-5-3-2-4-6-19/h2-10,20,23H,11-18H2,1H3,(H,27,31)(H,33,34)