(2-azanyl-2-oxidanylidene-ethyl)-[[1-(2-chloranylpyridin-3-yl)pyrrol-2-yl]methyl]azanium

Systemtic Name: (2-azanyl-2-oxidanylidene-ethyl)-[[1-(2-chloranylpyridin-3-yl)pyrrol-2-yl]methyl]azanium Openeye Name: (2-amino-2-oxo-ethyl)-[[1-(2-chloro-3-pyridyl)pyrrol-2-yl]methyl]ammonium CAS Name: (2-amino-2-oxoethyl)-[[1-(2-chloro-3-pyridinyl)-2-pyrrolyl]methyl]ammonium IUPAC Name: (2-amino-2-oxoethyl)-[[1-(2-chloropyridin-3-yl)pyrrol-2-yl]methyl]azanium Traditional Name: (2-amino-2-keto-ethyl)-[[1-(2-chloro-3-pyridyl)pyrrol-2-yl]methyl]ammonium Formula: C12H14ClN4O+ MolecularWeight: 265.71876

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(N=C1)Cl)N2C=CC=C2C[NH2+]CC(=O)N

Isomeric SMILES

C1=CC(=C(N=C1)Cl)N2C=CC=C2C[NH2+]CC(=O)N

InChI

InChI=1S/C12H13ClN4O/c13-12-10(4-1-5-16-12)17-6-2-3-9(17)7-15-8-11(14)18/h1-6,15H,7-8H2,(H2,14,18)/p+1