N-[(R)-1,3-benzodioxol-5-yl-(2-methyl-1H-indol-3-yl)methyl]-4-methyl-pyridin-1-ium-2-amine

Systemtic Name: N-[(R)-1,3-benzodioxol-5-yl-(2-methyl-1H-indol-3-yl)methyl]-4-methyl-pyridin-1-ium-2-amine Openeye Name: N-[(R)-1,3-benzodioxol-5-yl-(2-methyl-1H-indol-3-yl)methyl]-4-methyl-pyridin-1-ium-2-amine CAS Name: N-[(R)-1,3-benzodioxol-5-yl-(2-methyl-1H-indol-3-yl)methyl]-4-methyl-2-pyridin-1-iumamine IUPAC Name: N-[(R)-1,3-benzodioxol-5-yl-(2-methyl-1H-indol-3-yl)methyl]-4-methylpyridin-1-ium-2-amine Traditional Name: [(R)-1,3-benzodioxol-5-yl-(2-methyl-1H-indol-3-yl)methyl]-(4-methylpyridin-1-ium-2-yl)amine Formula: C23H22N3O2+ MolecularWeight: 372.43968

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[NH+]C=C1)NC(C2=CC3=C(C=C2)OCO3)C4=C(NC5=CC=CC=C54)C

Isomeric SMILES

CC1=CC(=[NH+]C=C1)N[C@H](C2=CC3=C(C=C2)OCO3)C4=C(NC5=CC=CC=C54)C

InChI

InChI=1S/C23H21N3O2/c1-14-9-10-24-21(11-14)26-23(16-7-8-19-20(12-16)28-13-27-19)22-15(2)25-18-6-4-3-5-17(18)22/h3-12,23,25H,13H2,1-2H3,(H,24,26)/p+1/t23-/m1/s1