diethyl-[2-[(3-nitroazulen-1-yl)carbonylamino]ethyl]azanium chloride

Systemtic Name: diethyl-[2-[(3-nitroazulen-1-yl)carbonylamino]ethyl]azanium chloride Openeye Name: diethyl-[2-[(3-nitroazulene-1-carbonyl)amino]ethyl]ammonium chloride CAS Name: diethyl-[2-[[(3-nitro-1-azulenyl)-oxomethyl]amino]ethyl]ammonium chloride IUPAC Name: diethyl-[2-[(3-nitroazulene-1-carbonyl)amino]ethyl]azanium chloride Traditional Name: diethyl-[2-[(3-nitroazulene-1-carbonyl)amino]ethyl]ammonium chloride Formula: C17H22ClN3O3 MolecularWeight: 351.82788

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCNC(=O)C1=CC(=C2C1=CC=CC=C2)[N+](=O)[O-].[Cl-]

Isomeric SMILES

CC[NH+](CC)CCNC(=O)C1=CC(=C2C1=CC=CC=C2)[N+](=O)[O-].[Cl-]

InChI

InChI=1S/C17H21N3O3.ClH/c1-3-19(4-2)11-10-18-17(21)15-12-16(20(22)23)14-9-7-5-6-8-13(14)15;/h5-9,12H,3-4,10-11H2,1-2H3,(H,18,21);1H