diethyl-[2-[(4-nitrophenyl)carbonyl-(2-oxidanylidene-2-piperidin-1-yl-ethyl)amino]ethyl]azanium

Systemtic Name: diethyl-[2-[(4-nitrophenyl)carbonyl-(2-oxidanylidene-2-piperidin-1-yl-ethyl)amino]ethyl]azanium Openeye Name: diethyl-[2-[(4-nitrobenzoyl)-[2-oxo-2-(1-piperidyl)ethyl]amino]ethyl]ammonium CAS Name: diethyl-[2-[[(4-nitrophenyl)-oxomethyl]-[2-oxo-2-(1-piperidinyl)ethyl]amino]ethyl]ammonium IUPAC Name: diethyl-[2-[(4-nitrobenzoyl)-(2-oxo-2-piperidin-1-ylethyl)amino]ethyl]azanium Traditional Name: diethyl-[2-[(2-keto-2-piperidino-ethyl)-(4-nitrobenzoyl)amino]ethyl]ammonium Formula: C20H31N4O4+ MolecularWeight: 391.48454

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCN(CC(=O)N1CCCCC1)C(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC[NH+](CC)CCN(CC(=O)N1CCCCC1)C(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C20H30N4O4/c1-3-21(4-2)14-15-23(16-19(25)22-12-6-5-7-13-22)20(26)17-8-10-18(11-9-17)24(27)28/h8-11H,3-7,12-16H2,1-2H3/p+1