1,3-benzodioxol-5-ylmethyl-[(2R)-1-(2,3-dihydroindol-1-yl)-1-oxidanylidene-propan-2-yl]-methyl-azanium

Systemtic Name: 1,3-benzodioxol-5-ylmethyl-[(2R)-1-(2,3-dihydroindol-1-yl)-1-oxidanylidene-propan-2-yl]-methyl-azanium Openeye Name: 1,3-benzodioxol-5-ylmethyl-[(1R)-2-indolin-1-yl-1-methyl-2-oxo-ethyl]-methyl-ammonium CAS Name: 1,3-benzodioxol-5-ylmethyl-[(2R)-1-(2,3-dihydroindol-1-yl)-1-oxopropan-2-yl]-methylammonium IUPAC Name: 1,3-benzodioxol-5-ylmethyl-[(2R)-1-(2,3-dihydroindol-1-yl)-1-oxopropan-2-yl]-methylazanium Traditional Name: [(1R)-2-indolin-1-yl-2-keto-1-methyl-ethyl]-methyl-piperonyl-ammonium Formula: C20H23N2O3+ MolecularWeight: 339.40822

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCC2=CC=CC=C21)[NH+](C)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C[C@H](C(=O)N1CCC2=CC=CC=C21)[NH+](C)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C20H22N2O3/c1-14(20(23)22-10-9-16-5-3-4-6-17(16)22)21(2)12-15-7-8-18-19(11-15)25-13-24-18/h3-8,11,14H,9-10,12-13H2,1-2H3/p+1/t14-/m1/s1