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

Systemtic Name: 1,3-benzodioxol-5-ylmethyl-methyl-[(2R)-1-oxidanylidene-1-[(phenylmethyl)amino]propan-2-yl]azanium Openeye Name: 1,3-benzodioxol-5-ylmethyl-[(1R)-2-(benzylamino)-1-methyl-2-oxo-ethyl]-methyl-ammonium CAS Name: 1,3-benzodioxol-5-ylmethyl-methyl-[(2R)-1-oxo-1-[(phenylmethyl)amino]propan-2-yl]ammonium IUPAC Name: 1,3-benzodioxol-5-ylmethyl-[(2R)-1-(benzylamino)-1-oxopropan-2-yl]-methylazanium Traditional Name: [(1R)-2-(benzylamino)-2-keto-1-methyl-ethyl]-methyl-piperonyl-ammonium Formula: C19H23N2O3+ MolecularWeight: 327.39752

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=CC=C1)[NH+](C)CC2=CC3=C(C=C2)OCO3

Isomeric SMILES

C[C@H](C(=O)NCC1=CC=CC=C1)[NH+](C)CC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C19H22N2O3/c1-14(19(22)20-11-15-6-4-3-5-7-15)21(2)12-16-8-9-17-18(10-16)24-13-23-17/h3-10,14H,11-13H2,1-2H3,(H,20,22)/p+1/t14-/m1/s1