2-[(E)-2-(1,3-benzodioxol-5-yl)ethenyl]-3-(2,5-dimethoxyphenyl)quinazolin-4-one

Systemtic Name: 2-[(E)-2-(1,3-benzodioxol-5-yl)ethenyl]-3-(2,5-dimethoxyphenyl)quinazolin-4-one Openeye Name: 2-[(E)-2-(1,3-benzodioxol-5-yl)vinyl]-3-(2,5-dimethoxyphenyl)quinazolin-4-one CAS Name: 2-[(E)-2-(1,3-benzodioxol-5-yl)ethenyl]-3-(2,5-dimethoxyphenyl)-4-quinazolinone IUPAC Name: 2-[(E)-2-(1,3-benzodioxol-5-yl)ethenyl]-3-(2,5-dimethoxyphenyl)quinazolin-4-one Traditional Name: 2-[(E)-2-(1,3-benzodioxol-5-yl)vinyl]-3-(2,5-dimethoxyphenyl)quinazolin-4-one Formula: C25H20N2O5 MolecularWeight: 428.4367

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)N2C(=NC3=CC=CC=C3C2=O)C=CC4=CC5=C(C=C4)OCO5

Isomeric SMILES

COC1=CC(=C(C=C1)OC)N2C(=NC3=CC=CC=C3C2=O)/C=C/C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C25H20N2O5/c1-29-17-9-11-21(30-2)20(14-17)27-24(26-19-6-4-3-5-18(19)25(27)28)12-8-16-7-10-22-23(13-16)32-15-31-22/h3-14H,15H2,1-2H3/b12-8+