N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-3-[4-(2-propan-2-ylfuran-3-yl)sulfonylphenoxy]propan-1-amine

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-3-[4-(2-propan-2-ylfuran-3-yl)sulfonylphenoxy]propan-1-amine Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-3-[4-[(2-isopropyl-3-furyl)sulfonyl]phenoxy]-N-methyl-propan-1-amine CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-3-[4-[(2-propan-2-yl-3-furanyl)sulfonyl]phenoxy]-1-propanamine IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-3-[4-(2-propan-2-ylfuran-3-yl)sulfonylphenoxy]propan-1-amine Traditional Name: homoveratryl-[3-[4-[(2-isopropyl-3-furyl)sulfonyl]phenoxy]propyl]-methyl-amine Formula: C27H35NO6S MolecularWeight: 501.6349

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C=CO1)S(=O)(=O)C2=CC=C(C=C2)OCCCN(C)CCC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC(C)C1=C(C=CO1)S(=O)(=O)C2=CC=C(C=C2)OCCCN(C)CCC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C27H35NO6S/c1-20(2)27-26(14-18-34-27)35(29,30)23-10-8-22(9-11-23)33-17-6-15-28(3)16-13-21-7-12-24(31-4)25(19-21)32-5/h7-12,14,18-20H,6,13,15-17H2,1-5H3