ethyl 4-[1-azanyl-1-oxidanylidene-3-(2-piperidin-1-ylphenyl)octan-2-yl]benzoate

Systemtic Name: ethyl 4-[1-azanyl-1-oxidanylidene-3-(2-piperidin-1-ylphenyl)octan-2-yl]benzoate Openeye Name: ethyl 4-[1-carbamoyl-2-[2-(1-piperidyl)phenyl]heptyl]benzoate CAS Name: 4-[1-amino-1-oxo-3-[2-(1-piperidinyl)phenyl]octan-2-yl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[1-amino-1-oxo-3-(2-piperidin-1-ylphenyl)octan-2-yl]benzoate Traditional Name: 4-[1-carbamoyl-2-(2-piperidinophenyl)heptyl]benzoic acid ethyl ester Formula: C28H38N2O3 MolecularWeight: 450.61292

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C1=CC=CC=C1N2CCCCC2)C(C3=CC=C(C=C3)C(=O)OCC)C(=O)N

Isomeric SMILES

CCCCCC(C1=CC=CC=C1N2CCCCC2)C(C3=CC=C(C=C3)C(=O)OCC)C(=O)N

InChI

InChI=1S/C28H38N2O3/c1-3-5-7-13-24(23-12-8-9-14-25(23)30-19-10-6-11-20-30)26(27(29)31)21-15-17-22(18-16-21)28(32)33-4-2/h8-9,12,14-18,24,26H,3-7,10-11,13,19-20H2,1-2H3,(H2,29,31)