methyl 2-[(Z)-1-chloranyl-2-pyridin-3-yl-ethenyl]-4-oxidanylidene-1H-quinazoline-7-carboxylate

Systemtic Name: methyl 2-[(Z)-1-chloranyl-2-pyridin-3-yl-ethenyl]-4-oxidanylidene-1H-quinazoline-7-carboxylate Openeye Name: methyl 2-[(Z)-1-chloro-2-(3-pyridyl)vinyl]-4-oxo-1H-quinazoline-7-carboxylate CAS Name: 2-[(Z)-1-chloro-2-(3-pyridinyl)ethenyl]-4-oxo-1H-quinazoline-7-carboxylic acid methyl ester IUPAC Name: methyl 2-[(Z)-1-chloro-2-pyridin-3-ylethenyl]-4-oxo-1H-quinazoline-7-carboxylate Traditional Name: 2-[(Z)-1-chloro-2-(3-pyridyl)vinyl]-4-keto-1H-quinazoline-7-carboxylic acid methyl ester Formula: C17H12ClN3O3 MolecularWeight: 341.74848

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)C(=O)N=C(N2)C(=CC3=CN=CC=C3)Cl

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)C(=O)N=C(N2)/C(=C/C3=CN=CC=C3)/Cl

InChI

InChI=1S/C17H12ClN3O3/c1-24-17(23)11-4-5-12-14(8-11)20-15(21-16(12)22)13(18)7-10-3-2-6-19-9-10/h2-9H,1H3,(H,20,21,22)/b13-7-