[2-[(4-chloranyl-3-nitro-phenyl)amino]-2-oxidanylidene-ethyl]-cyclohexyl-methyl-azanium

Systemtic Name: [2-[(4-chloranyl-3-nitro-phenyl)amino]-2-oxidanylidene-ethyl]-cyclohexyl-methyl-azanium Openeye Name: [2-(4-chloro-3-nitro-anilino)-2-oxo-ethyl]-cyclohexyl-methyl-ammonium CAS Name: [2-(4-chloro-3-nitroanilino)-2-oxoethyl]-cyclohexyl-methylammonium IUPAC Name: [2-(4-chloro-3-nitroanilino)-2-oxoethyl]-cyclohexyl-methylazanium Traditional Name: [2-(4-chloro-3-nitro-anilino)-2-keto-ethyl]-cyclohexyl-methyl-ammonium Formula: C15H21ClN3O3+ MolecularWeight: 326.79854

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC(=O)NC1=CC(=C(C=C1)Cl)[N+](=O)[O-])C2CCCCC2

Isomeric SMILES

C[NH+](CC(=O)NC1=CC(=C(C=C1)Cl)[N+](=O)[O-])C2CCCCC2

InChI

InChI=1S/C15H20ClN3O3/c1-18(12-5-3-2-4-6-12)10-15(20)17-11-7-8-13(16)14(9-11)19(21)22/h7-9,12H,2-6,10H2,1H3,(H,17,20)/p+1