[2-(cyclohexylcarbamoylamino)-2-oxidanylidene-ethyl] 4-nitrobenzoate

Systemtic Name: [2-(cyclohexylcarbamoylamino)-2-oxidanylidene-ethyl] 4-nitrobenzoate Openeye Name: [2-(cyclohexylcarbamoylamino)-2-oxo-ethyl] 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [2-[[(cyclohexylamino)-oxomethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-(cyclohexylcarbamoylamino)-2-oxoethyl] 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid [2-(cyclohexylcarbamoylamino)-2-keto-ethyl] ester Formula: C16H19N3O6 MolecularWeight: 349.33856

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)NC(=O)COC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1CCC(CC1)NC(=O)NC(=O)COC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H19N3O6/c20-14(18-16(22)17-12-4-2-1-3-5-12)10-25-15(21)11-6-8-13(9-7-11)19(23)24/h6-9,12H,1-5,10H2,(H2,17,18,20,22)