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

Systemtic Name: 1,3-benzodioxol-5-ylmethyl-[(1S)-1-(3-chlorophenyl)propyl]azanium Openeye Name: 1,3-benzodioxol-5-ylmethyl-[(1S)-1-(3-chlorophenyl)propyl]ammonium CAS Name: 1,3-benzodioxol-5-ylmethyl-[(1S)-1-(3-chlorophenyl)propyl]ammonium IUPAC Name: 1,3-benzodioxol-5-ylmethyl-[(1S)-1-(3-chlorophenyl)propyl]azanium Traditional Name: [(1S)-1-(3-chlorophenyl)propyl]-piperonyl-ammonium Formula: C17H19ClNO2+ MolecularWeight: 304.79126

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18ClNO2/c1-2-15(13-4-3-5-14(18)9-13)19-10-12-6-7-16-17(8-12)21-11-20-16/h3-9,15,19H,2,10-11H2,1H3/p+1/t15-/m0/s1