[1-phenethyl-4-[phenyl(propanoyl)amino]piperidin-4-yl]methyl 2,2-dimethylpropanoate

Systemtic Name: [1-phenethyl-4-[phenyl(propanoyl)amino]piperidin-4-yl]methyl 2,2-dimethylpropanoate Openeye Name: [1-phenethyl-4-(N-propanoylanilino)-4-piperidyl]methyl 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid [4-[N-(1-oxopropyl)anilino]-1-phenethyl-4-piperidinyl]methyl ester IUPAC Name: [1-phenethyl-4-(N-propanoylanilino)piperidin-4-yl]methyl 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid [1-phenethyl-4-(N-propionylanilino)-4-piperidyl]methyl ester Formula: C28H38N2O3 MolecularWeight: 450.61292

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N(C1=CC=CC=C1)C2(CCN(CC2)CCC3=CC=CC=C3)COC(=O)C(C)(C)C

Isomeric SMILES

CCC(=O)N(C1=CC=CC=C1)C2(CCN(CC2)CCC3=CC=CC=C3)COC(=O)C(C)(C)C

InChI

InChI=1S/C28H38N2O3/c1-5-25(31)30(24-14-10-7-11-15-24)28(22-33-26(32)27(2,3)4)17-20-29(21-18-28)19-16-23-12-8-6-9-13-23/h6-15H,5,16-22H2,1-4H3