methyl (E)-4-[(2-methylphenyl)methylamino]-4-oxidanylidene-but-2-enoate

Systemtic Name: methyl (E)-4-[(2-methylphenyl)methylamino]-4-oxidanylidene-but-2-enoate Openeye Name: methyl (E)-4-(o-tolylmethylamino)-4-oxo-but-2-enoate CAS Name: (E)-4-[(2-methylphenyl)methylamino]-4-oxo-2-butenoic acid methyl ester IUPAC Name: methyl (E)-4-[(2-methylphenyl)methylamino]-4-oxobut-2-enoate Traditional Name: (E)-4-keto-4-[(2-methylbenzyl)amino]but-2-enoic acid methyl ester Formula: C13H15NO3 MolecularWeight: 233.2631

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H15NO3/c1-10-5-3-4-6-11(10)9-14-12(15)7-8-13(16)17-2/h3-8H,9H2,1-2H3,(H,14,15)/b8-7+