N-[(3,4-dimethoxyphenyl)methyl]-2-[[4-(2-hydroxyethylcarbamoyl)cyclohexyl]amino]-5-nitro-benzamide

Systemtic Name: N-[(3,4-dimethoxyphenyl)methyl]-2-[[4-(2-hydroxyethylcarbamoyl)cyclohexyl]amino]-5-nitro-benzamide Openeye Name: N-[(3,4-dimethoxyphenyl)methyl]-2-[[4-(2-hydroxyethylcarbamoyl)cyclohexyl]amino]-5-nitro-benzamide CAS Name: N-[(3,4-dimethoxyphenyl)methyl]-2-[[4-[(2-hydroxyethylamino)-oxomethyl]cyclohexyl]amino]-5-nitrobenzamide IUPAC Name: N-[(3,4-dimethoxyphenyl)methyl]-2-[[4-(2-hydroxyethylcarbamoyl)cyclohexyl]amino]-5-nitrobenzamide Traditional Name: 2-[[4-(2-hydroxyethylcarbamoyl)cyclohexyl]amino]-5-nitro-N-veratryl-benzamide Formula: C25H32N4O7 MolecularWeight: 500.54418

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])NC3CCC(CC3)C(=O)NCCO)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CNC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])NC3CCC(CC3)C(=O)NCCO)OC

InChI

InChI=1S/C25H32N4O7/c1-35-22-10-3-16(13-23(22)36-2)15-27-25(32)20-14-19(29(33)34)8-9-21(20)28-18-6-4-17(5-7-18)24(31)26-11-12-30/h3,8-10,13-14,17-18,28,30H,4-7,11-12,15H2,1-2H3,(H,26,31)(H,27,32)