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

Systemtic Name: (2S)-4-methyl-2-[3-(3-methylphenoxy)propanoylamino]pentanoic acid Openeye Name: (2S)-4-methyl-2-[3-(3-methylphenoxy)propanoylamino]pentanoic acid CAS Name: (2S)-4-methyl-2-[[3-(3-methylphenoxy)-1-oxopropyl]amino]pentanoic acid IUPAC Name: (2S)-4-methyl-2-[3-(3-methylphenoxy)propanoylamino]pentanoic acid Traditional Name: (2S)-4-methyl-2-[3-(3-methylphenoxy)propanoylamino]valeric acid Formula: C16H23NO4 MolecularWeight: 293.35812

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H23NO4/c1-11(2)9-14(16(19)20)17-15(18)7-8-21-13-6-4-5-12(3)10-13/h4-6,10-11,14H,7-9H2,1-3H3,(H,17,18)(H,19,20)/t14-/m0/s1