methyl 5-nitro-2-[(4-oxidanylcyclohexyl)amino]benzoate

Systemtic Name: methyl 5-nitro-2-[(4-oxidanylcyclohexyl)amino]benzoate Openeye Name: methyl 2-[(4-hydroxycyclohexyl)amino]-5-nitro-benzoate CAS Name: 2-[(4-hydroxycyclohexyl)amino]-5-nitrobenzoic acid methyl ester IUPAC Name: methyl 2-[(4-hydroxycyclohexyl)amino]-5-nitrobenzoate Traditional Name: 2-[(4-hydroxycyclohexyl)amino]-5-nitro-benzoic acid methyl ester Formula: C14H18N2O5 MolecularWeight: 294.30312

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CC(=C1)[N+](=O)[O-])NC2CCC(CC2)O

Isomeric SMILES

COC(=O)C1=C(C=CC(=C1)[N+](=O)[O-])NC2CCC(CC2)O

InChI

InChI=1S/C14H18N2O5/c1-21-14(18)12-8-10(16(19)20)4-7-13(12)15-9-2-5-11(17)6-3-9/h4,7-9,11,15,17H,2-3,5-6H2,1H3