methyl 4-[[4-[(3-cyanophenyl)carbonyl-(2-methoxyethyl)amino]piperidin-1-yl]methyl]benzoate

Systemtic Name: methyl 4-[[4-[(3-cyanophenyl)carbonyl-(2-methoxyethyl)amino]piperidin-1-yl]methyl]benzoate Openeye Name: methyl 4-[[4-[(3-cyanobenzoyl)-(2-methoxyethyl)amino]-1-piperidyl]methyl]benzoate CAS Name: 4-[[4-[[(3-cyanophenyl)-oxomethyl]-(2-methoxyethyl)amino]-1-piperidinyl]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[4-[(3-cyanobenzoyl)-(2-methoxyethyl)amino]piperidin-1-yl]methyl]benzoate Traditional Name: 4-[[4-[(3-cyanobenzoyl)-(2-methoxyethyl)amino]piperidino]methyl]benzoic acid methyl ester Formula: C25H29N3O4 MolecularWeight: 435.51546

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Descriptors Computed from Structure

Canonical SMILES:

COCCN(C1CCN(CC1)CC2=CC=C(C=C2)C(=O)OC)C(=O)C3=CC=CC(=C3)C#N

Isomeric SMILES

COCCN(C1CCN(CC1)CC2=CC=C(C=C2)C(=O)OC)C(=O)C3=CC=CC(=C3)C#N

InChI

InChI=1S/C25H29N3O4/c1-31-15-14-28(24(29)22-5-3-4-20(16-22)17-26)23-10-12-27(13-11-23)18-19-6-8-21(9-7-19)25(30)32-2/h3-9,16,23H,10-15,18H2,1-2H3