ethyl 4-[2-[1-(5-methyl-2-piperidin-1-yl-phenyl)butylamino]-2-oxidanylidene-ethyl]benzoate

Systemtic Name: ethyl 4-[2-[1-(5-methyl-2-piperidin-1-yl-phenyl)butylamino]-2-oxidanylidene-ethyl]benzoate Openeye Name: ethyl 4-[2-[1-[5-methyl-2-(1-piperidyl)phenyl]butylamino]-2-oxo-ethyl]benzoate CAS Name: 4-[2-[1-[5-methyl-2-(1-piperidinyl)phenyl]butylamino]-2-oxoethyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[2-[1-(5-methyl-2-piperidin-1-ylphenyl)butylamino]-2-oxoethyl]benzoate Traditional Name: 4-[2-keto-2-[1-(5-methyl-2-piperidino-phenyl)butylamino]ethyl]benzoic acid ethyl ester Formula: C27H36N2O3 MolecularWeight: 436.58634

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=C(C=CC(=C1)C)N2CCCCC2)NC(=O)CC3=CC=C(C=C3)C(=O)OCC

Isomeric SMILES

CCCC(C1=C(C=CC(=C1)C)N2CCCCC2)NC(=O)CC3=CC=C(C=C3)C(=O)OCC

InChI

InChI=1S/C27H36N2O3/c1-4-9-24(23-18-20(3)10-15-25(23)29-16-7-6-8-17-29)28-26(30)19-21-11-13-22(14-12-21)27(31)32-5-2/h10-15,18,24H,4-9,16-17,19H2,1-3H3,(H,28,30)