N-[(6-bromanyl-1,3-benzodioxol-5-yl)methyl]-3-phenyl-propan-1-amine

Systemtic Name: N-[(6-bromanyl-1,3-benzodioxol-5-yl)methyl]-3-phenyl-propan-1-amine Openeye Name: N-[(6-bromo-1,3-benzodioxol-5-yl)methyl]-3-phenyl-propan-1-amine CAS Name: N-[(6-bromo-1,3-benzodioxol-5-yl)methyl]-3-phenyl-1-propanamine IUPAC Name: N-[(6-bromo-1,3-benzodioxol-5-yl)methyl]-3-phenylpropan-1-amine Traditional Name: (6-bromo-1,3-benzodioxol-5-yl)methyl-(3-phenylpropyl)amine Formula: C17H18BrNO2 MolecularWeight: 348.23432

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C(=C2)CNCCCC3=CC=CC=C3)Br

Isomeric SMILES

C1OC2=C(O1)C=C(C(=C2)CNCCCC3=CC=CC=C3)Br

InChI

InChI=1S/C17H18BrNO2/c18-15-10-17-16(20-12-21-17)9-14(15)11-19-8-4-7-13-5-2-1-3-6-13/h1-3,5-6,9-10,19H,4,7-8,11-12H2