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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)O)NC(=O)CCC1=CC=C(C=C1)OC

Isomeric SMILES

CC[C@H](C)[C@@H](C(=O)O)NC(=O)CCC1=CC=C(C=C1)OC

InChI

InChI=1S/C16H23NO4/c1-4-11(2)15(16(19)20)17-14(18)10-7-12-5-8-13(21-3)9-6-12/h5-6,8-9,11,15H,4,7,10H2,1-3H3,(H,17,18)(H,19,20)/t11-,15-/m0/s1