butyl 4-[[1-(3-ethanoylphenyl)sulfonylpiperidin-4-yl]carbonylamino]benzoate

Systemtic Name: butyl 4-[[1-(3-ethanoylphenyl)sulfonylpiperidin-4-yl]carbonylamino]benzoate Openeye Name: butyl 4-[[1-(3-acetylphenyl)sulfonylpiperidine-4-carbonyl]amino]benzoate CAS Name: 4-[[[1-(3-acetylphenyl)sulfonyl-4-piperidinyl]-oxomethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[[1-(3-acetylphenyl)sulfonylpiperidine-4-carbonyl]amino]benzoate Traditional Name: 4-[[1-(3-acetylphenyl)sulfonylisonipecotoyl]amino]benzoic acid butyl ester Formula: C25H30N2O6S MolecularWeight: 486.5805

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)C(=O)C

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)C(=O)C

InChI

InChI=1S/C25H30N2O6S/c1-3-4-16-33-25(30)20-8-10-22(11-9-20)26-24(29)19-12-14-27(15-13-19)34(31,32)23-7-5-6-21(17-23)18(2)28/h5-11,17,19H,3-4,12-16H2,1-2H3,(H,26,29)