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

Systemtic Name: 2-[2-(4-aminophenyl)ethyl]-6-methoxy-5-pentoxy-isoquinolin-1-one Openeye Name: 2-[2-(4-aminophenyl)ethyl]-6-methoxy-5-pentoxy-isoquinolin-1-one CAS Name: 2-[2-(4-aminophenyl)ethyl]-6-methoxy-5-pentoxy-1-isoquinolinone IUPAC Name: 2-[2-(4-aminophenyl)ethyl]-6-methoxy-5-pentoxyisoquinolin-1-one Traditional Name: 2-[2-(4-aminophenyl)ethyl]-5-amoxy-6-methoxy-isocarbostyril Formula: C23H28N2O3 MolecularWeight: 380.48002

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H28N2O3/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