2-[[1-[3-(4-methoxyphenoxy)propyl]piperidin-3-yl]methyl]-6,7-dimethyl-3,4-dihydroisoquinolin-1-one

Systemtic Name: 2-[[1-[3-(4-methoxyphenoxy)propyl]piperidin-3-yl]methyl]-6,7-dimethyl-3,4-dihydroisoquinolin-1-one Openeye Name: 2-[[1-[3-(4-methoxyphenoxy)propyl]-3-piperidyl]methyl]-6,7-dimethyl-3,4-dihydroisoquinolin-1-one CAS Name: 2-[[1-[3-(4-methoxyphenoxy)propyl]-3-piperidinyl]methyl]-6,7-dimethyl-3,4-dihydroisoquinolin-1-one IUPAC Name: 2-[[1-[3-(4-methoxyphenoxy)propyl]piperidin-3-yl]methyl]-6,7-dimethyl-3,4-dihydroisoquinolin-1-one Traditional Name: 2-[[1-[3-(4-methoxyphenoxy)propyl]-3-piperidyl]methyl]-6,7-dimethyl-3,4-dihydroisocarbostyril Formula: C27H36N2O3 MolecularWeight: 436.58634

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)CCN(C2=O)CC3CCCN(C3)CCCOC4=CC=C(C=C4)OC)C

Isomeric SMILES

CC1=C(C=C2C(=C1)CCN(C2=O)CC3CCCN(C3)CCCOC4=CC=C(C=C4)OC)C

InChI

InChI=1S/C27H36N2O3/c1-20-16-23-11-14-29(27(30)26(23)17-21(20)2)19-22-6-4-12-28(18-22)13-5-15-32-25-9-7-24(31-3)8-10-25/h7-10,16-17,22H,4-6,11-15,18-19H2,1-3H3