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

Systemtic Name: 6-methoxy-2-[2-(4-methylphenyl)ethyl]-5-pentoxy-isoquinolin-1-one Openeye Name: 6-methoxy-5-pentoxy-2-[2-(p-tolyl)ethyl]isoquinolin-1-one CAS Name: 6-methoxy-2-[2-(4-methylphenyl)ethyl]-5-pentoxy-1-isoquinolinone IUPAC Name: 6-methoxy-2-[2-(4-methylphenyl)ethyl]-5-pentoxyisoquinolin-1-one Traditional Name: 5-amoxy-6-methoxy-2-[2-(p-tolyl)ethyl]isocarbostyril Formula: C24H29NO3 MolecularWeight: 379.49196

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H29NO3/c1-4-5-6-17-28-23-20-14-16-25(15-13-19-9-7-18(2)8-10-19)24(26)21(20)11-12-22(23)27-3/h7-12,14,16H,4-6,13,15,17H2,1-3H3