methyl 4-[2-(cyclohexylcarbamoylamino)-2-oxidanylidene-ethoxy]-3-nitro-benzoate

Systemtic Name: methyl 4-[2-(cyclohexylcarbamoylamino)-2-oxidanylidene-ethoxy]-3-nitro-benzoate Openeye Name: methyl 4-[2-(cyclohexylcarbamoylamino)-2-oxo-ethoxy]-3-nitro-benzoate CAS Name: 4-[2-[[(cyclohexylamino)-oxomethyl]amino]-2-oxoethoxy]-3-nitrobenzoic acid methyl ester IUPAC Name: methyl 4-[2-(cyclohexylcarbamoylamino)-2-oxoethoxy]-3-nitrobenzoate Traditional Name: 4-[2-(cyclohexylcarbamoylamino)-2-keto-ethoxy]-3-nitro-benzoic acid methyl ester Formula: C17H21N3O7 MolecularWeight: 379.36454

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)OCC(=O)NC(=O)NC2CCCCC2)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)OCC(=O)NC(=O)NC2CCCCC2)[N+](=O)[O-]

InChI

InChI=1S/C17H21N3O7/c1-26-16(22)11-7-8-14(13(9-11)20(24)25)27-10-15(21)19-17(23)18-12-5-3-2-4-6-12/h7-9,12H,2-6,10H2,1H3,(H2,18,19,21,23)