(Z)-4-azanyl-4-oxidanylidene-2-(2,4,6-trimethylphenyl)but-2-enoic acid

Systemtic Name: (Z)-4-azanyl-4-oxidanylidene-2-(2,4,6-trimethylphenyl)but-2-enoic acid Openeye Name: (Z)-4-amino-4-oxo-2-(2,4,6-trimethylphenyl)but-2-enoic acid CAS Name: (Z)-4-amino-4-oxo-2-(2,4,6-trimethylphenyl)-2-butenoic acid IUPAC Name: (Z)-4-amino-4-oxo-2-(2,4,6-trimethylphenyl)but-2-enoic acid Traditional Name: (Z)-4-amino-4-keto-2-mesityl-but-2-enoic acid Formula: C13H15NO3 MolecularWeight: 233.2631

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=CC(=C(C(=C1)C)/C(=C/C(=O)N)/C(=O)O)C

InChI

InChI=1S/C13H15NO3/c1-7-4-8(2)12(9(3)5-7)10(13(16)17)6-11(14)15/h4-6H,1-3H3,(H2,14,15)(H,16,17)/b10-6-