(2S,3S)-3-methyl-2-[[4-(phenylmethyl)piperidin-1-yl]carbonylamino]pentanoic acid

Systemtic Name: (2S,3S)-3-methyl-2-[[4-(phenylmethyl)piperidin-1-yl]carbonylamino]pentanoic acid Openeye Name: (2S,3S)-2-[(4-benzylpiperidine-1-carbonyl)amino]-3-methyl-pentanoic acid CAS Name: (2S,3S)-3-methyl-2-[[oxo-[4-(phenylmethyl)-1-piperidinyl]methyl]amino]pentanoic acid IUPAC Name: (2S,3S)-2-[(4-benzylpiperidine-1-carbonyl)amino]-3-methylpentanoic acid Traditional Name: (2S,3S)-2-[(4-benzylpiperidine-1-carbonyl)amino]-3-methyl-valeric acid Formula: C19H28N2O3 MolecularWeight: 332.43722

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)O)NC(=O)N1CCC(CC1)CC2=CC=CC=C2

Isomeric SMILES

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

InChI

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