(7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl (E)-3-(4-propan-2-ylphenyl)prop-2-enoate

Systemtic Name: (7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl (E)-3-(4-propan-2-ylphenyl)prop-2-enoate Openeye Name: (7-chloro-4-oxo-1H-quinazolin-2-yl)methyl (E)-3-(4-isopropylphenyl)prop-2-enoate CAS Name: (E)-3-(4-propan-2-ylphenyl)-2-propenoic acid (7-chloro-4-oxo-1H-quinazolin-2-yl)methyl ester IUPAC Name: (7-chloro-4-oxo-1H-quinazolin-2-yl)methyl (E)-3-(4-propan-2-ylphenyl)prop-2-enoate Traditional Name: (E)-3-p-cumenylacrylic acid (7-chloro-4-keto-1H-quinazolin-2-yl)methyl ester Formula: C21H19ClN2O3 MolecularWeight: 382.84016

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C=CC(=O)OCC2=NC(=O)C3=C(N2)C=C(C=C3)Cl

Isomeric SMILES

CC(C)C1=CC=C(C=C1)/C=C/C(=O)OCC2=NC(=O)C3=C(N2)C=C(C=C3)Cl

InChI

InChI=1S/C21H19ClN2O3/c1-13(2)15-6-3-14(4-7-15)5-10-20(25)27-12-19-23-18-11-16(22)8-9-17(18)21(26)24-19/h3-11,13H,12H2,1-2H3,(H,23,24,26)/b10-5+