6,7-dimethoxy-2-[1-[3-(4-propoxyphenoxy)propyl]piperidin-3-yl]-3,4-dihydroisoquinolin-1-one

Systemtic Name: 6,7-dimethoxy-2-[1-[3-(4-propoxyphenoxy)propyl]piperidin-3-yl]-3,4-dihydroisoquinolin-1-one Openeye Name: 6,7-dimethoxy-2-[1-[3-(4-propoxyphenoxy)propyl]-3-piperidyl]-3,4-dihydroisoquinolin-1-one CAS Name: 6,7-dimethoxy-2-[1-[3-(4-propoxyphenoxy)propyl]-3-piperidinyl]-3,4-dihydroisoquinolin-1-one IUPAC Name: 6,7-dimethoxy-2-[1-[3-(4-propoxyphenoxy)propyl]piperidin-3-yl]-3,4-dihydroisoquinolin-1-one Traditional Name: 6,7-dimethoxy-2-[1-[3-(4-propoxyphenoxy)propyl]-3-piperidyl]-3,4-dihydroisocarbostyril Formula: C28H38N2O5 MolecularWeight: 482.61172

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)OCCCN2CCCC(C2)N3CCC4=CC(=C(C=C4C3=O)OC)OC

Isomeric SMILES

CCCOC1=CC=C(C=C1)OCCCN2CCCC(C2)N3CCC4=CC(=C(C=C4C3=O)OC)OC

InChI

InChI=1S/C28H38N2O5/c1-4-16-34-23-8-10-24(11-9-23)35-17-6-14-29-13-5-7-22(20-29)30-15-12-21-18-26(32-2)27(33-3)19-25(21)28(30)31/h8-11,18-19,22H,4-7,12-17,20H2,1-3H3