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

Systemtic Name: 1,3-benzodioxol-5-ylmethyl-[2-[(2-chloranylpyridin-3-yl)amino]-2-oxidanylidene-ethyl]-methyl-azanium Openeye Name: 1,3-benzodioxol-5-ylmethyl-[2-[(2-chloro-3-pyridyl)amino]-2-oxo-ethyl]-methyl-ammonium CAS Name: 1,3-benzodioxol-5-ylmethyl-[2-[(2-chloro-3-pyridinyl)amino]-2-oxoethyl]-methylammonium IUPAC Name: 1,3-benzodioxol-5-ylmethyl-[2-[(2-chloropyridin-3-yl)amino]-2-oxoethyl]-methylazanium Traditional Name: [2-[(2-chloro-3-pyridyl)amino]-2-keto-ethyl]-methyl-piperonyl-ammonium Formula: C16H17ClN3O3+ MolecularWeight: 334.77748

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC2=C(C=C1)OCO2)CC(=O)NC3=C(N=CC=C3)Cl

Isomeric SMILES

C[NH+](CC1=CC2=C(C=C1)OCO2)CC(=O)NC3=C(N=CC=C3)Cl

InChI

InChI=1S/C16H16ClN3O3/c1-20(8-11-4-5-13-14(7-11)23-10-22-13)9-15(21)19-12-3-2-6-18-16(12)17/h2-7H,8-10H2,1H3,(H,19,21)/p+1