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

Systemtic Name: N-[(5-bromanylthiophen-2-yl)methyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-amine Openeye Name: N-[(5-bromo-2-thienyl)methyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-amine CAS Name: N-[(5-bromo-2-thiophenyl)methyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-amine IUPAC Name: N-[(5-bromothiophen-2-yl)methyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-amine Traditional Name: (5-bromo-2-thienyl)methyl-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)amine Formula: C14H14BrNO2S MolecularWeight: 340.23546

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)NCC3=CC=C(S3)Br)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)NCC3=CC=C(S3)Br)OC1

InChI

InChI=1S/C14H14BrNO2S/c15-14-5-3-11(19-14)9-16-10-2-4-12-13(8-10)18-7-1-6-17-12/h2-5,8,16H,1,6-7,9H2