1,3-benzodioxol-5-ylmethyl-[2-[[(1R)-1-(1-benzofuran-2-yl)ethyl]amino]-2-oxidanylidene-ethyl]-methyl-azanium

Systemtic Name: 1,3-benzodioxol-5-ylmethyl-[2-[[(1R)-1-(1-benzofuran-2-yl)ethyl]amino]-2-oxidanylidene-ethyl]-methyl-azanium Openeye Name: 1,3-benzodioxol-5-ylmethyl-[2-[[(1R)-1-(benzofuran-2-yl)ethyl]amino]-2-oxo-ethyl]-methyl-ammonium CAS Name: 1,3-benzodioxol-5-ylmethyl-[2-[[(1R)-1-(2-benzofuranyl)ethyl]amino]-2-oxoethyl]-methylammonium IUPAC Name: 1,3-benzodioxol-5-ylmethyl-[2-[[(1R)-1-(1-benzofuran-2-yl)ethyl]amino]-2-oxoethyl]-methylazanium Traditional Name: [2-[[(1R)-1-(benzofuran-2-yl)ethyl]amino]-2-keto-ethyl]-methyl-piperonyl-ammonium Formula: C21H23N2O4+ MolecularWeight: 367.41832

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=CC=CC=C2O1)NC(=O)C[NH+](C)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C[C@H](C1=CC2=CC=CC=C2O1)NC(=O)C[NH+](C)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C21H22N2O4/c1-14(19-10-16-5-3-4-6-17(16)27-19)22-21(24)12-23(2)11-15-7-8-18-20(9-15)26-13-25-18/h3-10,14H,11-13H2,1-2H3,(H,22,24)/p+1/t14-/m1/s1