N-[2-(3,4-dimethoxyphenyl)ethyl]-3-[4-(1H-inden-2-ylsulfonyl)phenoxy]-N-methyl-propan-1-amine

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-3-[4-(1H-inden-2-ylsulfonyl)phenoxy]-N-methyl-propan-1-amine Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-3-[4-(1H-inden-2-ylsulfonyl)phenoxy]-N-methyl-propan-1-amine CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-3-[4-(1H-inden-2-ylsulfonyl)phenoxy]-N-methyl-1-propanamine IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-3-[4-(1H-inden-2-ylsulfonyl)phenoxy]-N-methylpropan-1-amine Traditional Name: homoveratryl-[3-[4-(1H-inden-2-ylsulfonyl)phenoxy]propyl]-methyl-amine Formula: C29H33NO5S MolecularWeight: 507.64102

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCOC1=CC=C(C=C1)S(=O)(=O)C2=CC3=CC=CC=C3C2)CCC4=CC(=C(C=C4)OC)OC

Isomeric SMILES

CN(CCCOC1=CC=C(C=C1)S(=O)(=O)C2=CC3=CC=CC=C3C2)CCC4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C29H33NO5S/c1-30(17-15-22-9-14-28(33-2)29(19-22)34-3)16-6-18-35-25-10-12-26(13-11-25)36(31,32)27-20-23-7-4-5-8-24(23)21-27/h4-5,7-14,19-20H,6,15-18,21H2,1-3H3