1-azanyl-5-(3-methoxyphenyl)-7,8,9,10-tetrahydropyrimido[4,5-c]isoquinolin-6-one

Systemtic Name: 1-azanyl-5-(3-methoxyphenyl)-7,8,9,10-tetrahydropyrimido[4,5-c]isoquinolin-6-one Openeye Name: 1-amino-5-(3-methoxyphenyl)-7,8,9,10-tetrahydropyrimido[4,5-c]isoquinolin-6-one CAS Name: 1-amino-5-(3-methoxyphenyl)-7,8,9,10-tetrahydropyrimido[4,5-c]isoquinolin-6-one IUPAC Name: 1-amino-5-(3-methoxyphenyl)-7,8,9,10-tetrahydropyrimido[4,5-c]isoquinolin-6-one Traditional Name: 1-amino-5-(3-methoxyphenyl)-7,8,9,10-tetrahydropyrimid[4,5-c]isoquinolin-6-one Formula: C18H18N4O2 MolecularWeight: 322.36112

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2C3=C(C4=C(C2=O)CCCC4)C(=NC=N3)N

Isomeric SMILES

COC1=CC=CC(=C1)N2C3=C(C4=C(C2=O)CCCC4)C(=NC=N3)N

InChI

InChI=1S/C18H18N4O2/c1-24-12-6-4-5-11(9-12)22-17-15(16(19)20-10-21-17)13-7-2-3-8-14(13)18(22)23/h4-6,9-10H,2-3,7-8H2,1H3,(H2,19,20,21)