N-[[4-(2-azanyl-2-oxidanylidene-ethoxy)-3-methoxy-phenyl]methyl]-N-cyclohexyl-3-nitro-benzamide

Systemtic Name: N-[[4-(2-azanyl-2-oxidanylidene-ethoxy)-3-methoxy-phenyl]methyl]-N-cyclohexyl-3-nitro-benzamide Openeye Name: N-[[4-(2-amino-2-oxo-ethoxy)-3-methoxy-phenyl]methyl]-N-cyclohexyl-3-nitro-benzamide CAS Name: N-[[4-(2-amino-2-oxoethoxy)-3-methoxyphenyl]methyl]-N-cyclohexyl-3-nitrobenzamide IUPAC Name: N-[[4-(2-amino-2-oxoethoxy)-3-methoxyphenyl]methyl]-N-cyclohexyl-3-nitrobenzamide Traditional Name: N-[4-(2-amino-2-keto-ethoxy)-3-methoxy-benzyl]-N-cyclohexyl-3-nitro-benzamide Formula: C23H27N3O6 MolecularWeight: 441.47698

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CN(C2CCCCC2)C(=O)C3=CC(=CC=C3)[N+](=O)[O-])OCC(=O)N

Isomeric SMILES

COC1=C(C=CC(=C1)CN(C2CCCCC2)C(=O)C3=CC(=CC=C3)[N+](=O)[O-])OCC(=O)N

InChI

InChI=1S/C23H27N3O6/c1-31-21-12-16(10-11-20(21)32-15-22(24)27)14-25(18-7-3-2-4-8-18)23(28)17-6-5-9-19(13-17)26(29)30/h5-6,9-13,18H,2-4,7-8,14-15H2,1H3,(H2,24,27)