N-[2-(diphenylmethyl)oxyethyl]-2-(1-ethyl-6,7-dimethoxy-3,4-dihydroisochromen-1-yl)-N-methyl-ethanamine

Systemtic Name: N-[2-(diphenylmethyl)oxyethyl]-2-(1-ethyl-6,7-dimethoxy-3,4-dihydroisochromen-1-yl)-N-methyl-ethanamine Openeye Name: N-(2-benzhydryloxyethyl)-2-(1-ethyl-6,7-dimethoxy-isochroman-1-yl)-N-methyl-ethanamine CAS Name: N-[2-(diphenylmethyl)oxyethyl]-2-(1-ethyl-6,7-dimethoxy-3,4-dihydro-1H-2-benzopyran-1-yl)-N-methylethanamine IUPAC Name: N-(2-benzhydryloxyethyl)-2-(1-ethyl-6,7-dimethoxy-3,4-dihydroisochromen-1-yl)-N-methylethanamine Traditional Name: 2-benzhydryloxyethyl-[2-(1-ethyl-6,7-dimethoxy-isochroman-1-yl)ethyl]-methyl-amine Formula: C31H39NO4 MolecularWeight: 489.64566

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C2=CC(=C(C=C2CCO1)OC)OC)CCN(C)CCOC(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCC1(C2=CC(=C(C=C2CCO1)OC)OC)CCN(C)CCOC(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C31H39NO4/c1-5-31(27-23-29(34-4)28(33-3)22-26(27)16-20-36-31)17-18-32(2)19-21-35-30(24-12-8-6-9-13-24)25-14-10-7-11-15-25/h6-15,22-23,30H,5,16-21H2,1-4H3