(E)-4-[(2,4-dimethylphenyl)methyl-methyl-amino]-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (E)-4-[(2,4-dimethylphenyl)methyl-methyl-amino]-4-oxidanylidene-but-2-enoic acid Openeye Name: (E)-4-[(2,4-dimethylphenyl)methyl-methyl-amino]-4-oxo-but-2-enoic acid CAS Name: (E)-4-[(2,4-dimethylphenyl)methyl-methylamino]-4-oxo-2-butenoic acid IUPAC Name: (E)-4-[(2,4-dimethylphenyl)methyl-methylamino]-4-oxobut-2-enoic acid Traditional Name: (E)-4-[(2,4-dimethylbenzyl)-methyl-amino]-4-keto-but-2-enoic acid Formula: C14H17NO3 MolecularWeight: 247.28968

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H17NO3/c1-10-4-5-12(11(2)8-10)9-15(3)13(16)6-7-14(17)18/h4-8H,9H2,1-3H3,(H,17,18)/b7-6+