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

Systemtic Name: butyl 4-[[1-[(3-ethoxyphenyl)methyl]piperidin-4-yl]carbonylamino]benzoate Openeye Name: butyl 4-[[1-[(3-ethoxyphenyl)methyl]piperidine-4-carbonyl]amino]benzoate CAS Name: 4-[[[1-[(3-ethoxyphenyl)methyl]-4-piperidinyl]-oxomethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[[1-[(3-ethoxyphenyl)methyl]piperidine-4-carbonyl]amino]benzoate Traditional Name: 4-[[1-(3-ethoxybenzyl)isonipecotoyl]amino]benzoic acid butyl ester Formula: C26H34N2O4 MolecularWeight: 438.55916

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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)OCC

Isomeric SMILES

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

InChI

InChI=1S/C26H34N2O4/c1-3-5-17-32-26(30)22-9-11-23(12-10-22)27-25(29)21-13-15-28(16-14-21)19-20-7-6-8-24(18-20)31-4-2/h6-12,18,21H,3-5,13-17,19H2,1-2H3,(H,27,29)