1,3-benzodioxol-5-ylmethyl-[(1S)-1-(4-ethylphenyl)ethyl]azanium

Systemtic Name: 1,3-benzodioxol-5-ylmethyl-[(1S)-1-(4-ethylphenyl)ethyl]azanium Openeye Name: 1,3-benzodioxol-5-ylmethyl-[(1S)-1-(4-ethylphenyl)ethyl]ammonium CAS Name: 1,3-benzodioxol-5-ylmethyl-[(1S)-1-(4-ethylphenyl)ethyl]ammonium IUPAC Name: 1,3-benzodioxol-5-ylmethyl-[(1S)-1-(4-ethylphenyl)ethyl]azanium Traditional Name: [(1S)-1-(4-ethylphenyl)ethyl]-piperonyl-ammonium Formula: C18H22NO2+ MolecularWeight: 284.37278

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(C)[NH2+]CC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CCC1=CC=C(C=C1)[C@H](C)[NH2+]CC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C18H21NO2/c1-3-14-4-7-16(8-5-14)13(2)19-11-15-6-9-17-18(10-15)21-12-20-17/h4-10,13,19H,3,11-12H2,1-2H3/p+1/t13-/m0/s1