N-[[7-methyl-3-(oxidanylamino)-4-oxidanylidene-1,2-dihydroinden-5-yl]methyl]-2-pyridin-1-ium-1-yl-ethanamide chloride

Systemtic Name: N-[[7-methyl-3-(oxidanylamino)-4-oxidanylidene-1,2-dihydroinden-5-yl]methyl]-2-pyridin-1-ium-1-yl-ethanamide chloride Openeye Name: N-[[3-(hydroxyamino)-7-methyl-4-oxo-1,2-dihydroinden-5-yl]methyl]-2-pyridin-1-ium-1-yl-acetamide chloride CAS Name: N-[[3-(hydroxyamino)-7-methyl-4-oxo-1,2-dihydroinden-5-yl]methyl]-2-(1-pyridin-1-iumyl)acetamide chloride IUPAC Name: N-[[3-(hydroxyamino)-7-methyl-4-oxo-1,2-dihydroinden-5-yl]methyl]-2-pyridin-1-ium-1-ylacetamide chloride Traditional Name: N-[[3-(hydroxyamino)-4-keto-7-methyl-1,2-dihydroinden-5-yl]methyl]-2-pyridin-1-ium-1-yl-acetamide chloride Formula: C18H20ClN3O3 MolecularWeight: 361.8227

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C2CCC(=C2C(=O)C(=C1)CNC(=O)C[N+]3=CC=CC=C3)NO.[Cl-]

Isomeric SMILES

CC1=C2CCC(=C2C(=O)C(=C1)CNC(=O)C[N+]3=CC=CC=C3)NO.[Cl-]

InChI

InChI=1S/C18H19N3O3.ClH/c1-12-9-13(18(23)17-14(12)5-6-15(17)20-24)10-19-16(22)11-21-7-3-2-4-8-21;/h2-4,7-9H,5-6,10-11H2,1H3,(H2-,19,20,22,23,24);1H