[5,6-dimethoxy-3-[1-(3-phenylpropyl)piperidin-4-yl]-3,4-dihydro-1H-isochromen-1-yl]methanamine

Systemtic Name: [5,6-dimethoxy-3-[1-(3-phenylpropyl)piperidin-4-yl]-3,4-dihydro-1H-isochromen-1-yl]methanamine Openeye Name: [5,6-dimethoxy-3-[1-(3-phenylpropyl)-4-piperidyl]isochroman-1-yl]methanamine CAS Name: [5,6-dimethoxy-3-[1-(3-phenylpropyl)-4-piperidinyl]-3,4-dihydro-1H-2-benzopyran-1-yl]methanamine IUPAC Name: [5,6-dimethoxy-3-[1-(3-phenylpropyl)piperidin-4-yl]-3,4-dihydro-1H-isochromen-1-yl]methanamine Traditional Name: [5,6-dimethoxy-3-[1-(3-phenylpropyl)-4-piperidyl]isochroman-1-yl]methylamine Formula: C26H36N2O3 MolecularWeight: 424.57564

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=C(C=C1)C(OC(C2)C3CCN(CC3)CCCC4=CC=CC=C4)CN)OC

Isomeric SMILES

COC1=C(C2=C(C=C1)C(OC(C2)C3CCN(CC3)CCCC4=CC=CC=C4)CN)OC

InChI

InChI=1S/C26H36N2O3/c1-29-23-11-10-21-22(26(23)30-2)17-24(31-25(21)18-27)20-12-15-28(16-13-20)14-6-9-19-7-4-3-5-8-19/h3-5,7-8,10-11,20,24-25H,6,9,12-18,27H2,1-2H3