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

Systemtic Name: methyl 2-[(Z)-2-(3-bromophenyl)-1-chloranyl-ethenyl]-4-oxidanylidene-1H-quinazoline-7-carboxylate Openeye Name: methyl 2-[(Z)-2-(3-bromophenyl)-1-chloro-vinyl]-4-oxo-1H-quinazoline-7-carboxylate CAS Name: 2-[(Z)-2-(3-bromophenyl)-1-chloroethenyl]-4-oxo-1H-quinazoline-7-carboxylic acid methyl ester IUPAC Name: methyl 2-[(Z)-2-(3-bromophenyl)-1-chloroethenyl]-4-oxo-1H-quinazoline-7-carboxylate Traditional Name: 2-[(Z)-2-(3-bromophenyl)-1-chloro-vinyl]-4-keto-1H-quinazoline-7-carboxylic acid methyl ester Formula: C18H12BrClN2O3 MolecularWeight: 419.65648

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H12BrClN2O3/c1-25-18(24)11-5-6-13-15(9-11)21-16(22-17(13)23)14(20)8-10-3-2-4-12(19)7-10/h2-9H,1H3,(H,21,22,23)/b14-8-