methyl 5-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)-3-phenyl-1H-pyrazolo[1,5-a]pyrimidine-7-carboxylate

Systemtic Name: methyl 5-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)-3-phenyl-1H-pyrazolo[1,5-a]pyrimidine-7-carboxylate Openeye Name: methyl 5-(6-oxocyclohexa-2,4-dien-1-ylidene)-3-phenyl-1H-pyrazolo[1,5-a]pyrimidine-7-carboxylate CAS Name: 5-(6-oxo-1-cyclohexa-2,4-dienylidene)-3-phenyl-1H-pyrazolo[1,5-a]pyrimidine-7-carboxylic acid methyl ester IUPAC Name: methyl 5-(6-oxocyclohexa-2,4-dien-1-ylidene)-3-phenyl-1H-pyrazolo[1,5-a]pyrimidine-7-carboxylate Traditional Name: 5-(6-ketocyclohexa-2,4-dien-1-ylidene)-3-phenyl-1H-pyrazolo[1,5-a]pyrimidine-7-carboxylic acid methyl ester Formula: C20H15N3O3 MolecularWeight: 345.3514

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C2C=CC=CC2=O)N=C3N1NC=C3C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=CC(=C2C=CC=CC2=O)N=C3N1NC=C3C4=CC=CC=C4

InChI

InChI=1S/C20H15N3O3/c1-26-20(25)17-11-16(14-9-5-6-10-18(14)24)22-19-15(12-21-23(17)19)13-7-3-2-4-8-13/h2-12,21H,1H3