methyl 4-[[2-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)-1H-quinazolin-4-yl]amino]benzoate

Systemtic Name: methyl 4-[[2-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)-1H-quinazolin-4-yl]amino]benzoate Openeye Name: methyl 4-[[2-(6-oxocyclohexa-2,4-dien-1-ylidene)-1H-quinazolin-4-yl]amino]benzoate CAS Name: 4-[[2-(6-oxo-1-cyclohexa-2,4-dienylidene)-1H-quinazolin-4-yl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-(6-oxocyclohexa-2,4-dien-1-ylidene)-1H-quinazolin-4-yl]amino]benzoate Traditional Name: 4-[[2-(6-ketocyclohexa-2,4-dien-1-ylidene)-1H-quinazolin-4-yl]amino]benzoic acid methyl ester Formula: C22H17N3O3 MolecularWeight: 371.38868

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC2=NC(=C3C=CC=CC3=O)NC4=CC=CC=C42

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC2=NC(=C3C=CC=CC3=O)NC4=CC=CC=C42

InChI

InChI=1S/C22H17N3O3/c1-28-22(27)14-10-12-15(13-11-14)23-20-16-6-2-4-8-18(16)24-21(25-20)17-7-3-5-9-19(17)26/h2-13,24H,1H3,(H,23,25)