4-methyl-2-[[(E)-1-oxidanyl-1-oxidanylidene-4-phenyl-but-3-en-2-yl]amino]pentanoic acid

Systemtic Name: 4-methyl-2-[[(E)-1-oxidanyl-1-oxidanylidene-4-phenyl-but-3-en-2-yl]amino]pentanoic acid Openeye Name: 2-[[(E)-1-carboxy-3-phenyl-allyl]amino]-4-methyl-pentanoic acid CAS Name: 2-[[(E)-1-hydroxy-1-oxo-4-phenylbut-3-en-2-yl]amino]-4-methylpentanoic acid IUPAC Name: 2-[[(E)-1-hydroxy-1-oxo-4-phenylbut-3-en-2-yl]amino]-4-methylpentanoic acid Traditional Name: 2-[[(E)-1-carboxy-3-phenyl-allyl]amino]-4-methyl-valeric acid Formula: C16H21NO4 MolecularWeight: 291.34224

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(C)CC(C(=O)O)NC(/C=C/C1=CC=CC=C1)C(=O)O

InChI

InChI=1S/C16H21NO4/c1-11(2)10-14(16(20)21)17-13(15(18)19)9-8-12-6-4-3-5-7-12/h3-9,11,13-14,17H,10H2,1-2H3,(H,18,19)(H,20,21)/b9-8+