2-acetamido-5-(3-ethylphenyl)-3-oxidanylidene-pentanoic acid

Systemtic Name: 2-acetamido-5-(3-ethylphenyl)-3-oxidanylidene-pentanoic acid Openeye Name: 2-acetamido-5-(3-ethylphenyl)-3-oxo-pentanoic acid CAS Name: 2-acetamido-5-(3-ethylphenyl)-3-oxopentanoic acid IUPAC Name: 2-acetamido-5-(3-ethylphenyl)-3-oxopentanoic acid Traditional Name: 2-acetamido-5-(3-ethylphenyl)-3-keto-valeric acid Formula: C15H19NO4 MolecularWeight: 277.31566

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H19NO4/c1-3-11-5-4-6-12(9-11)7-8-13(18)14(15(19)20)16-10(2)17/h4-6,9,14H,3,7-8H2,1-2H3,(H,16,17)(H,19,20)