methyl 5-azanyl-2-[(E)-3-methoxy-3-oxidanylidene-prop-1-enyl]benzoate

Systemtic Name: methyl 5-azanyl-2-[(E)-3-methoxy-3-oxidanylidene-prop-1-enyl]benzoate Openeye Name: methyl 5-amino-2-[(E)-3-methoxy-3-oxo-prop-1-enyl]benzoate CAS Name: 5-amino-2-[(E)-3-methoxy-3-oxoprop-1-enyl]benzoic acid methyl ester IUPAC Name: methyl 5-amino-2-[(E)-3-methoxy-3-oxoprop-1-enyl]benzoate Traditional Name: 5-amino-2-[(E)-3-keto-3-methoxy-prop-1-enyl]benzoic acid methyl ester Formula: C12H13NO4 MolecularWeight: 235.23592

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

COC(=O)/C=C/C1=C(C=C(C=C1)N)C(=O)OC

InChI

InChI=1S/C12H13NO4/c1-16-11(14)6-4-8-3-5-9(13)7-10(8)12(15)17-2/h3-7H,13H2,1-2H3/b6-4+