methyl 4-[(E)-3-azanyl-2-methyl-3-oxidanylidene-prop-1-enyl]benzoate

Systemtic Name: methyl 4-[(E)-3-azanyl-2-methyl-3-oxidanylidene-prop-1-enyl]benzoate Openeye Name: methyl 4-[(E)-3-amino-2-methyl-3-oxo-prop-1-enyl]benzoate CAS Name: 4-[(E)-3-amino-2-methyl-3-oxoprop-1-enyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(E)-3-amino-2-methyl-3-oxoprop-1-enyl]benzoate Traditional Name: 4-[(E)-3-amino-3-keto-2-methyl-prop-1-enyl]benzoic acid methyl ester Formula: C12H13NO3 MolecularWeight: 219.23652

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C/C(=C\C1=CC=C(C=C1)C(=O)OC)/C(=O)N

InChI

InChI=1S/C12H13NO3/c1-8(11(13)14)7-9-3-5-10(6-4-9)12(15)16-2/h3-7H,1-2H3,(H2,13,14)/b8-7+