cyclopropyl-(3-methylbutyl)-[2-[(2-nitrophenyl)amino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: cyclopropyl-(3-methylbutyl)-[2-[(2-nitrophenyl)amino]-2-oxidanylidene-ethyl]azanium Openeye Name: cyclopropyl-isopentyl-[2-(2-nitroanilino)-2-oxo-ethyl]ammonium CAS Name: cyclopropyl-(3-methylbutyl)-[2-(2-nitroanilino)-2-oxoethyl]ammonium IUPAC Name: cyclopropyl-(3-methylbutyl)-[2-(2-nitroanilino)-2-oxoethyl]azanium Traditional Name: cyclopropyl-isoamyl-[2-keto-2-(2-nitroanilino)ethyl]ammonium Formula: C16H24N3O3+ MolecularWeight: 306.38006

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC[NH+](CC(=O)NC1=CC=CC=C1[N+](=O)[O-])C2CC2

Isomeric SMILES

CC(C)CC[NH+](CC(=O)NC1=CC=CC=C1[N+](=O)[O-])C2CC2

InChI

InChI=1S/C16H23N3O3/c1-12(2)9-10-18(13-7-8-13)11-16(20)17-14-5-3-4-6-15(14)19(21)22/h3-6,12-13H,7-11H2,1-2H3,(H,17,20)/p+1