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

Systemtic Name: 2-[2-(4-dimethylaminophenyl)ethyl]-6-methoxy-5-pentoxy-isoquinolin-1-one Openeye Name: 2-[2-(4-dimethylaminophenyl)ethyl]-6-methoxy-5-pentoxy-isoquinolin-1-one CAS Name: 2-[2-(4-dimethylaminophenyl)ethyl]-6-methoxy-5-pentoxy-1-isoquinolinone IUPAC Name: 2-[2-(4-dimethylaminophenyl)ethyl]-6-methoxy-5-pentoxyisoquinolin-1-one Traditional Name: 5-amoxy-2-[2-(4-dimethylaminophenyl)ethyl]-6-methoxy-isocarbostyril Formula: C25H32N2O3 MolecularWeight: 408.53318

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H32N2O3/c1-5-6-7-18-30-24-21-15-17-27(25(28)22(21)12-13-23(24)29-4)16-14-19-8-10-20(11-9-19)26(2)3/h8-13,15,17H,5-7,14,16,18H2,1-4H3