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methyl (E)-4-(6-ethanoylimino-3-oxidanylidene-cyclohexa-1,4-dien-1-yl)but-3-enoate

methyl (E)-4-(6-ethanoylimino-3-oxidanylidene-cyclohexa-1,4-dien-1-yl)but-3-enoate

Systemtic Name:methyl (E)-4-(6-ethanoylimino-3-oxidanylidene-cyclohexa-1,4-dien-1-yl)but-3-enoate
Openeye Name:methyl (E)-4-(6-acetylimino-3-oxo-cyclohexa-1,4-dien-1-yl)but-3-enoate
CAS Name:(E)-4-(6-acetylimino-3-oxo-1-cyclohexa-1,4-dienyl)-3-butenoic acid methyl ester
IUPAC Name:methyl (E)-4-(6-acetylimino-3-oxocyclohexa-1,4-dien-1-yl)but-3-enoate
Traditional Name:(E)-4-(6-acetylimino-3-keto-cyclohexa-1,4-dien-1-yl)but-3-enoic acid methyl ester
Formula: C13H13NO4
MolecularWeight: 247.24662
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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N=C1C=CC(=O)C=C1C=CCC(=O)OC


Isomeric SMILES

CC(=O)N=C1C=CC(=O)C=C1/C=C/CC(=O)OC


InChI

InChI=1S/C13H13NO4/c1-9(15)14-12-7-6-11(16)8-10(12)4-3-5-13(17)18-2/h3-4,6-8H,5H2,1-2H3/b4-3+,14-12?


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