ethyl 4-[2-[[(2-chloranyl-6-piperidin-1-yl-phenyl)-phenyl-methyl]amino]-2-oxidanylidene-ethyl]benzoate

Systemtic Name: ethyl 4-[2-[[(2-chloranyl-6-piperidin-1-yl-phenyl)-phenyl-methyl]amino]-2-oxidanylidene-ethyl]benzoate Openeye Name: ethyl 4-[2-[[[2-chloro-6-(1-piperidyl)phenyl]-phenyl-methyl]amino]-2-oxo-ethyl]benzoate CAS Name: 4-[2-[[[2-chloro-6-(1-piperidinyl)phenyl]-phenylmethyl]amino]-2-oxoethyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[2-[[(2-chloro-6-piperidin-1-ylphenyl)-phenylmethyl]amino]-2-oxoethyl]benzoate Traditional Name: 4-[2-[[(2-chloro-6-piperidino-phenyl)-phenyl-methyl]amino]-2-keto-ethyl]benzoic acid ethyl ester Formula: C29H31ClN2O3 MolecularWeight: 491.02104

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)CC(=O)NC(C2=CC=CC=C2)C3=C(C=CC=C3Cl)N4CCCCC4

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)CC(=O)NC(C2=CC=CC=C2)C3=C(C=CC=C3Cl)N4CCCCC4

InChI

InChI=1S/C29H31ClN2O3/c1-2-35-29(34)23-16-14-21(15-17-23)20-26(33)31-28(22-10-5-3-6-11-22)27-24(30)12-9-13-25(27)32-18-7-4-8-19-32/h3,5-6,9-17,28H,2,4,7-8,18-20H2,1H3,(H,31,33)