ethyl-[(4-nitrophenyl)methyl]-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]azanium

Systemtic Name: ethyl-[(4-nitrophenyl)methyl]-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]azanium Openeye Name: ethyl-[2-(isopropylamino)-2-oxo-ethyl]-[(4-nitrophenyl)methyl]ammonium CAS Name: ethyl-[(4-nitrophenyl)methyl]-[2-oxo-2-(propan-2-ylamino)ethyl]ammonium IUPAC Name: ethyl-[(4-nitrophenyl)methyl]-[2-oxo-2-(propan-2-ylamino)ethyl]azanium Traditional Name: ethyl-[2-(isopropylamino)-2-keto-ethyl]-(4-nitrobenzyl)ammonium Formula: C14H22N3O3+ MolecularWeight: 280.34278

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC1=CC=C(C=C1)[N+](=O)[O-])CC(=O)NC(C)C

Isomeric SMILES

CC[NH+](CC1=CC=C(C=C1)[N+](=O)[O-])CC(=O)NC(C)C

InChI

InChI=1S/C14H21N3O3/c1-4-16(10-14(18)15-11(2)3)9-12-5-7-13(8-6-12)17(19)20/h5-8,11H,4,9-10H2,1-3H3,(H,15,18)/p+1