(E)-4-[(4-methyl-1-phenyl-pentan-3-yl)amino]-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (E)-4-[(4-methyl-1-phenyl-pentan-3-yl)amino]-4-oxidanylidene-but-2-enoic acid Openeye Name: (E)-4-[(2-methyl-1-phenethyl-propyl)amino]-4-oxo-but-2-enoic acid CAS Name: (E)-4-[(4-methyl-1-phenylpentan-3-yl)amino]-4-oxo-2-butenoic acid IUPAC Name: (E)-4-[(4-methyl-1-phenylpentan-3-yl)amino]-4-oxobut-2-enoic acid Traditional Name: (E)-4-keto-4-[(2-methyl-1-phenethyl-propyl)amino]but-2-enoic acid Formula: C16H21NO3 MolecularWeight: 275.34284

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H21NO3/c1-12(2)14(17-15(18)10-11-16(19)20)9-8-13-6-4-3-5-7-13/h3-7,10-12,14H,8-9H2,1-2H3,(H,17,18)(H,19,20)/b11-10+