3-[[3-(aminomethyl)cyclohexyl]methyl]-2-(3,4,5-trimethoxyphenyl)quinazolin-4-one

Systemtic Name: 3-[[3-(aminomethyl)cyclohexyl]methyl]-2-(3,4,5-trimethoxyphenyl)quinazolin-4-one Openeye Name: 3-[[3-(aminomethyl)cyclohexyl]methyl]-2-(3,4,5-trimethoxyphenyl)quinazolin-4-one CAS Name: 3-[[3-(aminomethyl)cyclohexyl]methyl]-2-(3,4,5-trimethoxyphenyl)-4-quinazolinone IUPAC Name: 3-[[3-(aminomethyl)cyclohexyl]methyl]-2-(3,4,5-trimethoxyphenyl)quinazolin-4-one Traditional Name: 3-[[3-(aminomethyl)cyclohexyl]methyl]-2-(3,4,5-trimethoxyphenyl)quinazolin-4-one Formula: C25H31N3O4 MolecularWeight: 437.53134

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C2=NC3=CC=CC=C3C(=O)N2CC4CCCC(C4)CN

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C2=NC3=CC=CC=C3C(=O)N2CC4CCCC(C4)CN

InChI

InChI=1S/C25H31N3O4/c1-30-21-12-18(13-22(31-2)23(21)32-3)24-27-20-10-5-4-9-19(20)25(29)28(24)15-17-8-6-7-16(11-17)14-26/h4-5,9-10,12-13,16-17H,6-8,11,14-15,26H2,1-3H3