methyl 4-[(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)amino]-2,3-dihydrophthalazine-1-carboxylate

Systemtic Name: methyl 4-[(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)amino]-2,3-dihydrophthalazine-1-carboxylate Openeye Name: methyl 4-[(4-oxocyclohexa-2,5-dien-1-ylidene)amino]-2,3-dihydrophthalazine-1-carboxylate CAS Name: 4-[(4-oxo-1-cyclohexa-2,5-dienylidene)amino]-2,3-dihydrophthalazine-1-carboxylic acid methyl ester IUPAC Name: methyl 4-[(4-oxocyclohexa-2,5-dien-1-ylidene)amino]-2,3-dihydrophthalazine-1-carboxylate Traditional Name: 4-[(4-ketocyclohexa-2,5-dien-1-ylidene)amino]-2,3-dihydrophthalazine-1-carboxylic acid methyl ester Formula: C16H13N3O3 MolecularWeight: 295.29272

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C2C=CC=CC2=C(NN1)N=C3C=CC(=O)C=C3

Isomeric SMILES

COC(=O)C1=C2C=CC=CC2=C(NN1)N=C3C=CC(=O)C=C3

InChI

InChI=1S/C16H13N3O3/c1-22-16(21)14-12-4-2-3-5-13(12)15(19-18-14)17-10-6-8-11(20)9-7-10/h2-9,18-19H,1H3