(Z)-4-[(2-methylphenyl)methylamino]-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (Z)-4-[(2-methylphenyl)methylamino]-4-oxidanylidene-but-2-enoic acid Openeye Name: (Z)-4-(o-tolylmethylamino)-4-oxo-but-2-enoic acid CAS Name: (Z)-4-[(2-methylphenyl)methylamino]-4-oxo-2-butenoic acid IUPAC Name: (Z)-4-[(2-methylphenyl)methylamino]-4-oxobut-2-enoic acid Traditional Name: (Z)-4-keto-4-[(2-methylbenzyl)amino]but-2-enoic acid Formula: C12H13NO3 MolecularWeight: 219.23652

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CNC(=O)C=CC(=O)O

Isomeric SMILES

CC1=CC=CC=C1CNC(=O)/C=C\C(=O)O

InChI

InChI=1S/C12H13NO3/c1-9-4-2-3-5-10(9)8-13-11(14)6-7-12(15)16/h2-7H,8H2,1H3,(H,13,14)(H,15,16)/b7-6-