2-[(Z)-1-chloranyl-2-(4-methylphenyl)ethenyl]-4-oxidanylidene-1H-quinazoline-7-carboxylate

Systemtic Name: 2-[(Z)-1-chloranyl-2-(4-methylphenyl)ethenyl]-4-oxidanylidene-1H-quinazoline-7-carboxylate Openeye Name: 2-[(Z)-1-chloro-2-(p-tolyl)vinyl]-4-oxo-1H-quinazoline-7-carboxylate CAS Name: 2-[(Z)-1-chloro-2-(4-methylphenyl)ethenyl]-4-oxo-1H-quinazoline-7-carboxylate IUPAC Name: 2-[(Z)-1-chloro-2-(4-methylphenyl)ethenyl]-4-oxo-1H-quinazoline-7-carboxylate Traditional Name: 2-[(Z)-1-chloro-2-(p-tolyl)vinyl]-4-keto-1H-quinazoline-7-carboxylate Formula: C18H12ClN2O3- MolecularWeight: 339.75248

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C=C(C2=NC(=O)C3=C(N2)C=C(C=C3)C(=O)[O-])Cl

Isomeric SMILES

CC1=CC=C(C=C1)/C=C(/C2=NC(=O)C3=C(N2)C=C(C=C3)C(=O)[O-])\Cl

InChI

InChI=1S/C18H13ClN2O3/c1-10-2-4-11(5-3-10)8-14(19)16-20-15-9-12(18(23)24)6-7-13(15)17(22)21-16/h2-9H,1H3,(H,23,24)(H,20,21,22)/p-1/b14-8-