N-[(6-bromanyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-1-cyclopropyl-methanamine

Systemtic Name: N-[(6-bromanyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-1-cyclopropyl-methanamine Openeye Name: N-[(6-bromo-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-1-cyclopropyl-methanamine CAS Name: N-[(6-bromo-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-1-cyclopropylmethanamine IUPAC Name: N-[(6-bromo-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-1-cyclopropylmethanamine Traditional Name: (6-bromo-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl-(cyclopropylmethyl)amine Formula: C14H18BrNO2 MolecularWeight: 312.20222

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C(=CC(=C2)CNCC3CC3)Br)OC1

Isomeric SMILES

C1COC2=C(C(=CC(=C2)CNCC3CC3)Br)OC1

InChI

InChI=1S/C14H18BrNO2/c15-12-6-11(9-16-8-10-2-3-10)7-13-14(12)18-5-1-4-17-13/h6-7,10,16H,1-5,8-9H2