methyl 4-[butanoyl(phenyl)amino]-1-phenethyl-piperidine-4-carboxylate

Systemtic Name: methyl 4-[butanoyl(phenyl)amino]-1-phenethyl-piperidine-4-carboxylate Openeye Name: methyl 4-(N-butanoylanilino)-1-phenethyl-piperidine-4-carboxylate CAS Name: 4-[N-(1-oxobutyl)anilino]-1-phenethyl-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 4-(N-butanoylanilino)-1-phenethylpiperidine-4-carboxylate Traditional Name: 4-(N-butyrylanilino)-1-phenethyl-isonipecotic acid methyl ester Formula: C25H32N2O3 MolecularWeight: 408.53318

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)N(C1=CC=CC=C1)C2(CCN(CC2)CCC3=CC=CC=C3)C(=O)OC

Isomeric SMILES

CCCC(=O)N(C1=CC=CC=C1)C2(CCN(CC2)CCC3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C25H32N2O3/c1-3-10-23(28)27(22-13-8-5-9-14-22)25(24(29)30-2)16-19-26(20-17-25)18-15-21-11-6-4-7-12-21/h4-9,11-14H,3,10,15-20H2,1-2H3