[(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)methylamino] 3-methylbutanoate

Systemtic Name: [(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)methylamino] 3-methylbutanoate Openeye Name: [(4-oxocyclohexa-2,5-dien-1-ylidene)methylamino] 3-methylbutanoate CAS Name: 3-methylbutanoic acid [(4-oxo-1-cyclohexa-2,5-dienylidene)methylamino] ester IUPAC Name: [(4-oxocyclohexa-2,5-dien-1-ylidene)methylamino] 3-methylbutanoate Traditional Name: 3-methylbutyric acid [(4-ketocyclohexa-2,5-dien-1-ylidene)methylamino] ester Formula: C12H15NO3 MolecularWeight: 221.2524

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)ONC=C1C=CC(=O)C=C1

Isomeric SMILES

CC(C)CC(=O)ONC=C1C=CC(=O)C=C1

InChI

InChI=1S/C12H15NO3/c1-9(2)7-12(15)16-13-8-10-3-5-11(14)6-4-10/h3-6,8-9,13H,7H2,1-2H3