diethyl-[5-[(4-nitrophenyl)carbonylamino]-5-phenyl-pentyl]azanium chloride

Systemtic Name: diethyl-[5-[(4-nitrophenyl)carbonylamino]-5-phenyl-pentyl]azanium chloride Openeye Name: diethyl-[5-[(4-nitrobenzoyl)amino]-5-phenyl-pentyl]ammonium chloride CAS Name: diethyl-[5-[[(4-nitrophenyl)-oxomethyl]amino]-5-phenylpentyl]ammonium chloride IUPAC Name: diethyl-[5-[(4-nitrobenzoyl)amino]-5-phenylpentyl]azanium chloride Traditional Name: diethyl-[5-[(4-nitrobenzoyl)amino]-5-phenyl-pentyl]ammonium chloride Formula: C22H30ClN3O3 MolecularWeight: 419.9449

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCCCC(C1=CC=CC=C1)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-].[Cl-]

Isomeric SMILES

CC[NH+](CC)CCCCC(C1=CC=CC=C1)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-].[Cl-]

InChI

InChI=1S/C22H29N3O3.ClH/c1-3-24(4-2)17-9-8-12-21(18-10-6-5-7-11-18)23-22(26)19-13-15-20(16-14-19)25(27)28;/h5-7,10-11,13-16,21H,3-4,8-9,12,17H2,1-2H3,(H,23,26);1H