N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-1-(2,5-dimethylthiophen-3-yl)ethanamine

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-1-(2,5-dimethylthiophen-3-yl)ethanamine Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-1-(2,5-dimethyl-3-thienyl)ethanamine CAS Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-1-(2,5-dimethyl-3-thiophenyl)ethanamine IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-1-(2,5-dimethylthiophen-3-yl)ethanamine Traditional Name: 2,3-dihydro-1,4-benzodioxin-3-ylmethyl-[1-(2,5-dimethyl-3-thienyl)ethyl]amine Formula: C17H21NO2S MolecularWeight: 303.41914

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)C)C(C)NCC2COC3=CC=CC=C3O2

Isomeric SMILES

CC1=CC(=C(S1)C)C(C)NCC2COC3=CC=CC=C3O2

InChI

InChI=1S/C17H21NO2S/c1-11-8-15(13(3)21-11)12(2)18-9-14-10-19-16-6-4-5-7-17(16)20-14/h4-8,12,14,18H,9-10H2,1-3H3