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

Systemtic Name: methyl 2-[(Z)-2-(3-butoxy-4-methoxy-phenyl)-1-chloranyl-ethenyl]-4-oxidanylidene-1H-quinazoline-7-carboxylate Openeye Name: methyl 2-[(Z)-2-(3-butoxy-4-methoxy-phenyl)-1-chloro-vinyl]-4-oxo-1H-quinazoline-7-carboxylate CAS Name: 2-[(Z)-2-(3-butoxy-4-methoxyphenyl)-1-chloroethenyl]-4-oxo-1H-quinazoline-7-carboxylic acid methyl ester IUPAC Name: methyl 2-[(Z)-2-(3-butoxy-4-methoxyphenyl)-1-chloroethenyl]-4-oxo-1H-quinazoline-7-carboxylate Traditional Name: 2-[(Z)-2-(3-butoxy-4-methoxy-phenyl)-1-chloro-vinyl]-4-keto-1H-quinazoline-7-carboxylic acid methyl ester Formula: C23H23ClN2O5 MolecularWeight: 442.89212

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=CC(=C1)C=C(C2=NC(=O)C3=C(N2)C=C(C=C3)C(=O)OC)Cl)OC

Isomeric SMILES

CCCCOC1=C(C=CC(=C1)/C=C(/C2=NC(=O)C3=C(N2)C=C(C=C3)C(=O)OC)\Cl)OC

InChI

InChI=1S/C23H23ClN2O5/c1-4-5-10-31-20-12-14(6-9-19(20)29-2)11-17(24)21-25-18-13-15(23(28)30-3)7-8-16(18)22(27)26-21/h6-9,11-13H,4-5,10H2,1-3H3,(H,25,26,27)/b17-11-