2-(4-nitrophenyl)carbonyloxyethyl-pentan-3-yl-azanium

Systemtic Name: 2-(4-nitrophenyl)carbonyloxyethyl-pentan-3-yl-azanium Openeye Name: 1-ethylpropyl-[2-(4-nitrobenzoyl)oxyethyl]ammonium CAS Name: 2-[(4-nitrophenyl)-oxomethoxy]ethyl-pentan-3-ylammonium IUPAC Name: 2-(4-nitrobenzoyl)oxyethyl-pentan-3-ylazanium Traditional Name: 1-ethylpropyl-[2-(4-nitrobenzoyl)oxyethyl]ammonium Formula: C14H21N2O4+ MolecularWeight: 281.32754

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)[NH2+]CCOC(=O)C1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

CCC(CC)[NH2+]CCOC(=O)C1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C14H20N2O4/c1-3-12(4-2)15-9-10-20-14(17)11-5-7-13(8-6-11)16(18)19/h5-8,12,15H,3-4,9-10H2,1-2H3/p+1