2-[carboxy-[2-(2-methylphenyl)ethyl]amino]-4-methyl-pentanoic acid

Systemtic Name: 2-[carboxy-[2-(2-methylphenyl)ethyl]amino]-4-methyl-pentanoic acid Openeye Name: 2-[carboxy-[2-(o-tolyl)ethyl]amino]-4-methyl-pentanoic acid CAS Name: 2-[carboxy-[2-(2-methylphenyl)ethyl]amino]-4-methylpentanoic acid IUPAC Name: 2-[carboxy-[2-(2-methylphenyl)ethyl]amino]-4-methylpentanoic acid Traditional Name: 2-[carboxy-[2-(o-tolyl)ethyl]amino]-4-methyl-valeric acid Formula: C16H23NO4 MolecularWeight: 293.35812

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CCN(C(CC(C)C)C(=O)O)C(=O)O

Isomeric SMILES

CC1=CC=CC=C1CCN(C(CC(C)C)C(=O)O)C(=O)O

InChI

InChI=1S/C16H23NO4/c1-11(2)10-14(15(18)19)17(16(20)21)9-8-13-7-5-4-6-12(13)3/h4-7,11,14H,8-10H2,1-3H3,(H,18,19)(H,20,21)