[3-(1,3-benzodioxol-5-yl)-4-phenyl-butyl]-(phenylmethyl)azanium

Systemtic Name: [3-(1,3-benzodioxol-5-yl)-4-phenyl-butyl]-(phenylmethyl)azanium Openeye Name: [3-(1,3-benzodioxol-5-yl)-4-phenyl-butyl]-benzyl-ammonium CAS Name: [3-(1,3-benzodioxol-5-yl)-4-phenylbutyl]-(phenylmethyl)ammonium IUPAC Name: [3-(1,3-benzodioxol-5-yl)-4-phenylbutyl]-benzylazanium Traditional Name: [3-(1,3-benzodioxol-5-yl)-4-phenyl-butyl]-benzyl-ammonium Formula: C24H26NO2+ MolecularWeight: 360.46874

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(CC[NH2+]CC3=CC=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(CC[NH2+]CC3=CC=CC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C24H25NO2/c1-3-7-19(8-4-1)15-22(13-14-25-17-20-9-5-2-6-10-20)21-11-12-23-24(16-21)27-18-26-23/h1-12,16,22,25H,13-15,17-18H2/p+1