2-[2-(4-hydroxyphenyl)ethyl]-6-methoxy-3-oxidanyl-5-pentoxy-3,4-dihydroisoquinolin-1-one

Systemtic Name: 2-[2-(4-hydroxyphenyl)ethyl]-6-methoxy-3-oxidanyl-5-pentoxy-3,4-dihydroisoquinolin-1-one Openeye Name: 3-hydroxy-2-[2-(4-hydroxyphenyl)ethyl]-6-methoxy-5-pentoxy-3,4-dihydroisoquinolin-1-one CAS Name: 3-hydroxy-2-[2-(4-hydroxyphenyl)ethyl]-6-methoxy-5-pentoxy-3,4-dihydroisoquinolin-1-one IUPAC Name: 3-hydroxy-2-[2-(4-hydroxyphenyl)ethyl]-6-methoxy-5-pentoxy-3,4-dihydroisoquinolin-1-one Traditional Name: 5-amoxy-3-hydroxy-2-[2-(4-hydroxyphenyl)ethyl]-6-methoxy-3,4-dihydroisocarbostyril Formula: C23H29NO5 MolecularWeight: 399.48006

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=C(C=CC2=C1CC(N(C2=O)CCC3=CC=C(C=C3)O)O)OC

Isomeric SMILES

CCCCCOC1=C(C=CC2=C1CC(N(C2=O)CCC3=CC=C(C=C3)O)O)OC

InChI

InChI=1S/C23H29NO5/c1-3-4-5-14-29-22-19-15-21(26)24(13-12-16-6-8-17(25)9-7-16)23(27)18(19)10-11-20(22)28-2/h6-11,21,25-26H,3-5,12-15H2,1-2H3