2-[2-(4-aminophenyl)ethyl]-6-methoxy-5-pentoxy-isoquinolin-1-one hydrochloride

Systemtic Name: 2-[2-(4-aminophenyl)ethyl]-6-methoxy-5-pentoxy-isoquinolin-1-one hydrochloride Openeye Name: 2-[2-(4-aminophenyl)ethyl]-6-methoxy-5-pentoxy-isoquinolin-1-one hydrochloride CAS Name: 2-[2-(4-aminophenyl)ethyl]-6-methoxy-5-pentoxy-1-isoquinolinone hydrochloride IUPAC Name: 2-[2-(4-aminophenyl)ethyl]-6-methoxy-5-pentoxyisoquinolin-1-one hydrochloride Traditional Name: 2-[2-(4-aminophenyl)ethyl]-5-amoxy-6-methoxy-isocarbostyril hydrochloride Formula: C23H29ClN2O3 MolecularWeight: 416.94096

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=C(C=CC2=C1C=CN(C2=O)CCC3=CC=C(C=C3)N)OC.Cl

Isomeric SMILES

CCCCCOC1=C(C=CC2=C1C=CN(C2=O)CCC3=CC=C(C=C3)N)OC.Cl

InChI

InChI=1S/C23H28N2O3.ClH/c1-3-4-5-16-28-22-19-13-15-25(14-12-17-6-8-18(24)9-7-17)23(26)20(19)10-11-21(22)27-2;/h6-11,13,15H,3-5,12,14,16,24H2,1-2H3;1H