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

Systemtic Name: 2-[3-(4-ethylphenyl)propanoylamino]-3-methyl-pentanoic acid Openeye Name: 2-[3-(4-ethylphenyl)propanoylamino]-3-methyl-pentanoic acid CAS Name: 2-[[3-(4-ethylphenyl)-1-oxopropyl]amino]-3-methylpentanoic acid IUPAC Name: 2-[3-(4-ethylphenyl)propanoylamino]-3-methylpentanoic acid Traditional Name: 2-[3-(4-ethylphenyl)propanoylamino]-3-methyl-valeric acid Formula: C17H25NO3 MolecularWeight: 291.3853

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H25NO3/c1-4-12(3)16(17(20)21)18-15(19)11-10-14-8-6-13(5-2)7-9-14/h6-9,12,16H,4-5,10-11H2,1-3H3,(H,18,19)(H,20,21)