1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-(thiophen-2-ylmethylamino)ethanol

Systemtic Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-(thiophen-2-ylmethylamino)ethanol Openeye Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-(2-thienylmethylamino)ethanol CAS Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-(thiophen-2-ylmethylamino)ethanol IUPAC Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-(thiophen-2-ylmethylamino)ethanol Traditional Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-(2-thenylamino)ethanol Formula: C16H19NO3S MolecularWeight: 305.39196

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)C(CNCC3=CC=CS3)O)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)C(CNCC3=CC=CS3)O)OC1

InChI

InChI=1S/C16H19NO3S/c18-14(11-17-10-13-3-1-8-21-13)12-4-5-15-16(9-12)20-7-2-6-19-15/h1,3-5,8-9,14,17-18H,2,6-7,10-11H2