3,7-bis(azanyl)-4-(4-methoxyphenyl)-2-(3-methoxypropyl)isoquinolin-1-one

Systemtic Name: 3,7-bis(azanyl)-4-(4-methoxyphenyl)-2-(3-methoxypropyl)isoquinolin-1-one Openeye Name: 3,7-diamino-4-(4-methoxyphenyl)-2-(3-methoxypropyl)isoquinolin-1-one CAS Name: 3,7-diamino-4-(4-methoxyphenyl)-2-(3-methoxypropyl)-1-isoquinolinone IUPAC Name: 3,7-diamino-4-(4-methoxyphenyl)-2-(3-methoxypropyl)isoquinolin-1-one Traditional Name: 3,7-diamino-4-(4-methoxyphenyl)-2-(3-methoxypropyl)isocarbostyril Formula: C20H23N3O3 MolecularWeight: 353.41492

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCCCN1C(=C(C2=C(C1=O)C=C(C=C2)N)C3=CC=C(C=C3)OC)N

Isomeric SMILES

COCCCN1C(=C(C2=C(C1=O)C=C(C=C2)N)C3=CC=C(C=C3)OC)N

InChI

InChI=1S/C20H23N3O3/c1-25-11-3-10-23-19(22)18(13-4-7-15(26-2)8-5-13)16-9-6-14(21)12-17(16)20(23)24/h4-9,12H,3,10-11,21-22H2,1-2H3