methyl 2-[4-[[(4-piperidin-1-ylphenyl)carbamoylamino]methyl]phenyl]benzoate

Systemtic Name: methyl 2-[4-[[(4-piperidin-1-ylphenyl)carbamoylamino]methyl]phenyl]benzoate Openeye Name: methyl 2-[4-[[[4-(1-piperidyl)phenyl]carbamoylamino]methyl]phenyl]benzoate CAS Name: 2-[4-[[[oxo-[4-(1-piperidinyl)anilino]methyl]amino]methyl]phenyl]benzoic acid methyl ester IUPAC Name: methyl 2-[4-[[(4-piperidin-1-ylphenyl)carbamoylamino]methyl]phenyl]benzoate Traditional Name: 2-[4-[[(4-piperidinophenyl)carbamoylamino]methyl]phenyl]benzoic acid methyl ester Formula: C27H29N3O3 MolecularWeight: 443.53746

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1C2=CC=C(C=C2)CNC(=O)NC3=CC=C(C=C3)N4CCCCC4

Isomeric SMILES

COC(=O)C1=CC=CC=C1C2=CC=C(C=C2)CNC(=O)NC3=CC=C(C=C3)N4CCCCC4

InChI

InChI=1S/C27H29N3O3/c1-33-26(31)25-8-4-3-7-24(25)21-11-9-20(10-12-21)19-28-27(32)29-22-13-15-23(16-14-22)30-17-5-2-6-18-30/h3-4,7-16H,2,5-6,17-19H2,1H3,(H2,28,29,32)