(2S)-4-methyl-2-[3-[methyl-(phenylmethyl)amino]propanoylamino]pentanoic acid

Systemtic Name: (2S)-4-methyl-2-[3-[methyl-(phenylmethyl)amino]propanoylamino]pentanoic acid Openeye Name: (2S)-2-[3-[benzyl(methyl)amino]propanoylamino]-4-methyl-pentanoic acid CAS Name: (2S)-4-methyl-2-[[3-[methyl-(phenylmethyl)amino]-1-oxopropyl]amino]pentanoic acid IUPAC Name: (2S)-2-[3-[benzyl(methyl)amino]propanoylamino]-4-methylpentanoic acid Traditional Name: (2S)-2-[3-[benzyl(methyl)amino]propanoylamino]-4-methyl-valeric acid Formula: C17H26N2O3 MolecularWeight: 306.39994

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)O)NC(=O)CCN(C)CC1=CC=CC=C1

Isomeric SMILES

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

InChI

InChI=1S/C17H26N2O3/c1-13(2)11-15(17(21)22)18-16(20)9-10-19(3)12-14-7-5-4-6-8-14/h4-8,13,15H,9-12H2,1-3H3,(H,18,20)(H,21,22)/t15-/m0/s1