2-azanyl-1-(4-methoxyphenyl)-6,7-bis(phenylmethoxy)isoquinolin-3-one

Systemtic Name: 2-azanyl-1-(4-methoxyphenyl)-6,7-bis(phenylmethoxy)isoquinolin-3-one Openeye Name: 2-amino-6,7-dibenzyloxy-1-(4-methoxyphenyl)isoquinolin-3-one CAS Name: 2-amino-1-(4-methoxyphenyl)-6,7-bis(phenylmethoxy)-3-isoquinolinone IUPAC Name: 2-amino-1-(4-methoxyphenyl)-6,7-bis(phenylmethoxy)isoquinolin-3-one Traditional Name: 2-amino-6,7-dibenzoxy-1-(4-methoxyphenyl)-3-isoquinolone Formula: C30H26N2O4 MolecularWeight: 478.53844

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=C3C=C(C(=CC3=CC(=O)N2N)OCC4=CC=CC=C4)OCC5=CC=CC=C5

Isomeric SMILES

COC1=CC=C(C=C1)C2=C3C=C(C(=CC3=CC(=O)N2N)OCC4=CC=CC=C4)OCC5=CC=CC=C5

InChI

InChI=1S/C30H26N2O4/c1-34-25-14-12-23(13-15-25)30-26-18-28(36-20-22-10-6-3-7-11-22)27(16-24(26)17-29(33)32(30)31)35-19-21-8-4-2-5-9-21/h2-18H,19-20,31H2,1H3