butyl 4-[[1-[(3-methylphenyl)methyl]piperidin-4-yl]carbonylamino]benzoate

Systemtic Name: butyl 4-[[1-[(3-methylphenyl)methyl]piperidin-4-yl]carbonylamino]benzoate Openeye Name: butyl 4-[[1-(m-tolylmethyl)piperidine-4-carbonyl]amino]benzoate CAS Name: 4-[[[1-[(3-methylphenyl)methyl]-4-piperidinyl]-oxomethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[[1-[(3-methylphenyl)methyl]piperidine-4-carbonyl]amino]benzoate Traditional Name: 4-[[1-(3-methylbenzyl)isonipecotoyl]amino]benzoic acid butyl ester Formula: C25H32N2O3 MolecularWeight: 408.53318

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C2CCN(CC2)CC3=CC=CC(=C3)C

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C2CCN(CC2)CC3=CC=CC(=C3)C

InChI

InChI=1S/C25H32N2O3/c1-3-4-16-30-25(29)22-8-10-23(11-9-22)26-24(28)21-12-14-27(15-13-21)18-20-7-5-6-19(2)17-20/h5-11,17,21H,3-4,12-16,18H2,1-2H3,(H,26,28)