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

Systemtic Name: 6,7-dimethoxy-2-[1-[3-(4-oxidanylphenoxy)propyl]piperidin-3-yl]-3,4-dihydroisoquinolin-1-one Openeye Name: 2-[1-[3-(4-hydroxyphenoxy)propyl]-3-piperidyl]-6,7-dimethoxy-3,4-dihydroisoquinolin-1-one CAS Name: 2-[1-[3-(4-hydroxyphenoxy)propyl]-3-piperidinyl]-6,7-dimethoxy-3,4-dihydroisoquinolin-1-one IUPAC Name: 2-[1-[3-(4-hydroxyphenoxy)propyl]piperidin-3-yl]-6,7-dimethoxy-3,4-dihydroisoquinolin-1-one Traditional Name: 2-[1-[3-(4-hydroxyphenoxy)propyl]-3-piperidyl]-6,7-dimethoxy-3,4-dihydroisocarbostyril Formula: C25H32N2O5 MolecularWeight: 440.53198

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)CCN(C2=O)C3CCCN(C3)CCCOC4=CC=C(C=C4)O)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)CCN(C2=O)C3CCCN(C3)CCCOC4=CC=C(C=C4)O)OC

InChI

InChI=1S/C25H32N2O5/c1-30-23-15-18-10-13-27(25(29)22(18)16-24(23)31-2)19-5-3-11-26(17-19)12-4-14-32-21-8-6-20(28)7-9-21/h6-9,15-16,19,28H,3-5,10-14,17H2,1-2H3