1-[5,6-dimethoxy-3-(1-phenethylpiperidin-4-yl)-3,4-dihydro-1H-isochromen-1-yl]-N-methyl-methanamine

Systemtic Name: 1-[5,6-dimethoxy-3-(1-phenethylpiperidin-4-yl)-3,4-dihydro-1H-isochromen-1-yl]-N-methyl-methanamine Openeye Name: 1-[5,6-dimethoxy-3-(1-phenethyl-4-piperidyl)isochroman-1-yl]-N-methyl-methanamine CAS Name: 1-[5,6-dimethoxy-3-(1-phenethyl-4-piperidinyl)-3,4-dihydro-1H-2-benzopyran-1-yl]-N-methylmethanamine IUPAC Name: 1-[5,6-dimethoxy-3-(1-phenethylpiperidin-4-yl)-3,4-dihydro-1H-isochromen-1-yl]-N-methylmethanamine Traditional Name: [5,6-dimethoxy-3-(1-phenethyl-4-piperidyl)isochroman-1-yl]methyl-methyl-amine Formula: C26H36N2O3 MolecularWeight: 424.57564

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Descriptors Computed from Structure

Canonical SMILES:

CNCC1C2=C(CC(O1)C3CCN(CC3)CCC4=CC=CC=C4)C(=C(C=C2)OC)OC

Isomeric SMILES

CNCC1C2=C(CC(O1)C3CCN(CC3)CCC4=CC=CC=C4)C(=C(C=C2)OC)OC

InChI

InChI=1S/C26H36N2O3/c1-27-18-25-21-9-10-23(29-2)26(30-3)22(21)17-24(31-25)20-12-15-28(16-13-20)14-11-19-7-5-4-6-8-19/h4-10,20,24-25,27H,11-18H2,1-3H3