N-[1-(3-bromanylthiophen-2-yl)ethyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-amine

Systemtic Name: N-[1-(3-bromanylthiophen-2-yl)ethyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-amine Openeye Name: N-[1-(3-bromo-2-thienyl)ethyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-amine CAS Name: N-[1-(3-bromo-2-thiophenyl)ethyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-amine IUPAC Name: N-[1-(3-bromothiophen-2-yl)ethyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-amine Traditional Name: 1-(3-bromo-2-thienyl)ethyl-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)amine Formula: C15H16BrNO2S MolecularWeight: 354.26204

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(C=CS1)Br)NC2=CC3=C(C=C2)OCCCO3

Isomeric SMILES

CC(C1=C(C=CS1)Br)NC2=CC3=C(C=C2)OCCCO3

InChI

InChI=1S/C15H16BrNO2S/c1-10(15-12(16)5-8-20-15)17-11-3-4-13-14(9-11)19-7-2-6-18-13/h3-5,8-10,17H,2,6-7H2,1H3