1,3-benzodioxol-5-ylmethyl-[(1S)-1-(4-bromophenyl)propyl]azanium

Systemtic Name: 1,3-benzodioxol-5-ylmethyl-[(1S)-1-(4-bromophenyl)propyl]azanium Openeye Name: 1,3-benzodioxol-5-ylmethyl-[(1S)-1-(4-bromophenyl)propyl]ammonium CAS Name: 1,3-benzodioxol-5-ylmethyl-[(1S)-1-(4-bromophenyl)propyl]ammonium IUPAC Name: 1,3-benzodioxol-5-ylmethyl-[(1S)-1-(4-bromophenyl)propyl]azanium Traditional Name: [(1S)-1-(4-bromophenyl)propyl]-piperonyl-ammonium Formula: C17H19BrNO2+ MolecularWeight: 349.24226

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=C(C=C1)Br)[NH2+]CC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC[C@@H](C1=CC=C(C=C1)Br)[NH2+]CC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C17H18BrNO2/c1-2-15(13-4-6-14(18)7-5-13)19-10-12-3-8-16-17(9-12)21-11-20-16/h3-9,15,19H,2,10-11H2,1H3/p+1/t15-/m0/s1