3-(1,3-benzodioxol-5-ylmethyl)-2-(3-chloranyl-5-ethoxy-4-methoxy-phenyl)-1,2-dihydroquinazolin-4-one

Systemtic Name: 3-(1,3-benzodioxol-5-ylmethyl)-2-(3-chloranyl-5-ethoxy-4-methoxy-phenyl)-1,2-dihydroquinazolin-4-one Openeye Name: 3-(1,3-benzodioxol-5-ylmethyl)-2-(3-chloro-5-ethoxy-4-methoxy-phenyl)-1,2-dihydroquinazolin-4-one CAS Name: 3-(1,3-benzodioxol-5-ylmethyl)-2-(3-chloro-5-ethoxy-4-methoxyphenyl)-1,2-dihydroquinazolin-4-one IUPAC Name: 3-(1,3-benzodioxol-5-ylmethyl)-2-(3-chloro-5-ethoxy-4-methoxyphenyl)-1,2-dihydroquinazolin-4-one Traditional Name: 2-(3-chloro-5-ethoxy-4-methoxy-phenyl)-3-piperonyl-1,2-dihydroquinazolin-4-one Formula: C25H23ClN2O5 MolecularWeight: 466.91352

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C2NC3=CC=CC=C3C(=O)N2CC4=CC5=C(C=C4)OCO5)Cl)OC

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C2NC3=CC=CC=C3C(=O)N2CC4=CC5=C(C=C4)OCO5)Cl)OC

InChI

InChI=1S/C25H23ClN2O5/c1-3-31-22-12-16(11-18(26)23(22)30-2)24-27-19-7-5-4-6-17(19)25(29)28(24)13-15-8-9-20-21(10-15)33-14-32-20/h4-12,24,27H,3,13-14H2,1-2H3