O3-[(2S)-1-[cyclohexyl(ethyl)amino]-1-oxidanylidene-propan-2-yl] O1-methyl 5-nitrobenzene-1,3-dicarboxylate

Systemtic Name: O3-[(2S)-1-[cyclohexyl(ethyl)amino]-1-oxidanylidene-propan-2-yl] O1-methyl 5-nitrobenzene-1,3-dicarboxylate Openeye Name: O3-[(1S)-2-[cyclohexyl(ethyl)amino]-1-methyl-2-oxo-ethyl] O1-methyl 5-nitrobenzene-1,3-dicarboxylate CAS Name: 5-nitrobenzene-1,3-dicarboxylic acid O3-[(2S)-1-[cyclohexyl(ethyl)amino]-1-oxopropan-2-yl] ester O1-methyl ester IUPAC Name: 3-O-[(2S)-1-[cyclohexyl(ethyl)amino]-1-oxopropan-2-yl] 1-O-methyl 5-nitrobenzene-1,3-dicarboxylate Traditional Name: 5-nitrobenzene-1,3-dicarboxylic acid O3-[(1S)-2-[cyclohexyl(ethyl)amino]-2-keto-1-methyl-ethyl] ester O1-methyl ester Formula: C20H26N2O7 MolecularWeight: 406.42964

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1CCCCC1)C(=O)C(C)OC(=O)C2=CC(=CC(=C2)C(=O)OC)[N+](=O)[O-]

Isomeric SMILES

CCN(C1CCCCC1)C(=O)[C@H](C)OC(=O)C2=CC(=CC(=C2)C(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C20H26N2O7/c1-4-21(16-8-6-5-7-9-16)18(23)13(2)29-20(25)15-10-14(19(24)28-3)11-17(12-15)22(26)27/h10-13,16H,4-9H2,1-3H3/t13-/m0/s1