3-[[3-(aminomethyl)cyclohexyl]methyl]-7-chloranyl-2-(3-methoxyphenyl)quinazolin-4-one

Systemtic Name: 3-[[3-(aminomethyl)cyclohexyl]methyl]-7-chloranyl-2-(3-methoxyphenyl)quinazolin-4-one Openeye Name: 3-[[3-(aminomethyl)cyclohexyl]methyl]-7-chloro-2-(3-methoxyphenyl)quinazolin-4-one CAS Name: 3-[[3-(aminomethyl)cyclohexyl]methyl]-7-chloro-2-(3-methoxyphenyl)-4-quinazolinone IUPAC Name: 3-[[3-(aminomethyl)cyclohexyl]methyl]-7-chloro-2-(3-methoxyphenyl)quinazolin-4-one Traditional Name: 3-[[3-(aminomethyl)cyclohexyl]methyl]-7-chloro-2-(3-methoxyphenyl)quinazolin-4-one Formula: C23H26ClN3O2 MolecularWeight: 411.92444

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=NC3=C(C=CC(=C3)Cl)C(=O)N2CC4CCCC(C4)CN

Isomeric SMILES

COC1=CC=CC(=C1)C2=NC3=C(C=CC(=C3)Cl)C(=O)N2CC4CCCC(C4)CN

InChI

InChI=1S/C23H26ClN3O2/c1-29-19-7-3-6-17(11-19)22-26-21-12-18(24)8-9-20(21)23(28)27(22)14-16-5-2-4-15(10-16)13-25/h3,6-9,11-12,15-16H,2,4-5,10,13-14,25H2,1H3