[2-(cyclohexylamino)-2-oxidanylidene-ethyl] 3-nitrobenzoate

Systemtic Name: [2-(cyclohexylamino)-2-oxidanylidene-ethyl] 3-nitrobenzoate Openeye Name: [2-(cyclohexylamino)-2-oxo-ethyl] 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid [2-(cyclohexylamino)-2-oxoethyl] ester IUPAC Name: [2-(cyclohexylamino)-2-oxoethyl] 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid [2-(cyclohexylamino)-2-keto-ethyl] ester Formula: C15H18N2O5 MolecularWeight: 306.31382

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H18N2O5/c18-14(16-12-6-2-1-3-7-12)10-22-15(19)11-5-4-8-13(9-11)17(20)21/h4-5,8-9,12H,1-3,6-7,10H2,(H,16,18)