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

Systemtic Name: methyl 4-[[6-methyl-2-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)-1H-pyrimidin-4-yl]amino]benzoate Openeye Name: methyl 4-[[6-methyl-2-(6-oxocyclohexa-2,4-dien-1-ylidene)-1H-pyrimidin-4-yl]amino]benzoate CAS Name: 4-[[6-methyl-2-(6-oxo-1-cyclohexa-2,4-dienylidene)-1H-pyrimidin-4-yl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[6-methyl-2-(6-oxocyclohexa-2,4-dien-1-ylidene)-1H-pyrimidin-4-yl]amino]benzoate Traditional Name: 4-[[2-(6-ketocyclohexa-2,4-dien-1-ylidene)-6-methyl-1H-pyrimidin-4-yl]amino]benzoic acid methyl ester Formula: C19H17N3O3 MolecularWeight: 335.35658

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=C2C=CC=CC2=O)N1)NC3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CC1=CC(=NC(=C2C=CC=CC2=O)N1)NC3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C19H17N3O3/c1-12-11-17(21-14-9-7-13(8-10-14)19(24)25-2)22-18(20-12)15-5-3-4-6-16(15)23/h3-11,20H,1-2H3,(H,21,22)