[2-oxidanylidene-2-[4-(phenylmethyl)piperidin-1-yl]ethyl] (2S)-2-benzamido-3-methyl-butanoate

Systemtic Name: [2-oxidanylidene-2-[4-(phenylmethyl)piperidin-1-yl]ethyl] (2S)-2-benzamido-3-methyl-butanoate Openeye Name: [2-(4-benzyl-1-piperidyl)-2-oxo-ethyl] (2S)-2-benzamido-3-methyl-butanoate CAS Name: (2S)-2-benzamido-3-methylbutanoic acid [2-oxo-2-[4-(phenylmethyl)-1-piperidinyl]ethyl] ester IUPAC Name: [2-(4-benzylpiperidin-1-yl)-2-oxoethyl] (2S)-2-benzamido-3-methylbutanoate Traditional Name: (2S)-2-benzamido-3-methyl-butyric acid [2-(4-benzylpiperidino)-2-keto-ethyl] ester Formula: C26H32N2O4 MolecularWeight: 436.54328

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCC(=O)N1CCC(CC1)CC2=CC=CC=C2)NC(=O)C3=CC=CC=C3

Isomeric SMILES

CC(C)[C@@H](C(=O)OCC(=O)N1CCC(CC1)CC2=CC=CC=C2)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C26H32N2O4/c1-19(2)24(27-25(30)22-11-7-4-8-12-22)26(31)32-18-23(29)28-15-13-21(14-16-28)17-20-9-5-3-6-10-20/h3-12,19,21,24H,13-18H2,1-2H3,(H,27,30)/t24-/m0/s1