2-[(Z)-2-(4-butoxyphenyl)-1-chloranyl-ethenyl]-8-methyl-1H-quinazolin-4-one

Systemtic Name: 2-[(Z)-2-(4-butoxyphenyl)-1-chloranyl-ethenyl]-8-methyl-1H-quinazolin-4-one Openeye Name: 2-[(Z)-2-(4-butoxyphenyl)-1-chloro-vinyl]-8-methyl-1H-quinazolin-4-one CAS Name: 2-[(Z)-2-(4-butoxyphenyl)-1-chloroethenyl]-8-methyl-1H-quinazolin-4-one IUPAC Name: 2-[(Z)-2-(4-butoxyphenyl)-1-chloroethenyl]-8-methyl-1H-quinazolin-4-one Traditional Name: 2-[(Z)-2-(4-butoxyphenyl)-1-chloro-vinyl]-8-methyl-1H-quinazolin-4-one Formula: C21H21ClN2O2 MolecularWeight: 368.85664

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H21ClN2O2/c1-3-4-12-26-16-10-8-15(9-11-16)13-18(22)20-23-19-14(2)6-5-7-17(19)21(25)24-20/h5-11,13H,3-4,12H2,1-2H3,(H,23,24,25)/b18-13-