(5S)-5-azanyl-7-methyl-4-oxidanylidene-2-(phenylmethyl)octanoic acid

Systemtic Name: (5S)-5-azanyl-7-methyl-4-oxidanylidene-2-(phenylmethyl)octanoic acid Openeye Name: (5S)-5-amino-2-benzyl-7-methyl-4-oxo-octanoic acid CAS Name: (5S)-5-amino-7-methyl-4-oxo-2-(phenylmethyl)octanoic acid IUPAC Name: (5S)-5-amino-2-benzyl-7-methyl-4-oxooctanoic acid Traditional Name: (5S)-5-amino-2-benzyl-4-keto-7-methyl-caprylic acid Formula: C16H23NO3 MolecularWeight: 277.35872

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)CC(CC1=CC=CC=C1)C(=O)O)N

Isomeric SMILES

CC(C)C[C@@H](C(=O)CC(CC1=CC=CC=C1)C(=O)O)N

InChI

InChI=1S/C16H23NO3/c1-11(2)8-14(17)15(18)10-13(16(19)20)9-12-6-4-3-5-7-12/h3-7,11,13-14H,8-10,17H2,1-2H3,(H,19,20)/t13?,14-/m0/s1