(phenylmethyl) (2S)-1-[(2S,3S)-2-azanyl-3-methyl-pentanoyl]piperidine-2-carboxylate

Systemtic Name: (phenylmethyl) (2S)-1-[(2S,3S)-2-azanyl-3-methyl-pentanoyl]piperidine-2-carboxylate Openeye Name: benzyl (2S)-1-[(2S,3S)-2-amino-3-methyl-pentanoyl]piperidine-2-carboxylate CAS Name: (2S)-1-[(2S,3S)-2-amino-3-methyl-1-oxopentyl]-2-piperidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (2S)-1-[(2S,3S)-2-amino-3-methylpentanoyl]piperidine-2-carboxylate Traditional Name: (2S)-1-[(2S,3S)-2-amino-3-methyl-pentanoyl]pipecolinic acid benzyl ester Formula: C19H28N2O3 MolecularWeight: 332.43722

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)N1CCCCC1C(=O)OCC2=CC=CC=C2)N

Isomeric SMILES

CC[C@H](C)[C@@H](C(=O)N1CCCC[C@H]1C(=O)OCC2=CC=CC=C2)N

InChI

InChI=1S/C19H28N2O3/c1-3-14(2)17(20)18(22)21-12-8-7-11-16(21)19(23)24-13-15-9-5-4-6-10-15/h4-6,9-10,14,16-17H,3,7-8,11-13,20H2,1-2H3/t14-,16-,17-/m0/s1