N-[(2-chloranyl-5-methoxy-phenyl)methyl]-5-nitro-2-[(4-oxidanylcyclohexyl)amino]benzamide

Systemtic Name: N-[(2-chloranyl-5-methoxy-phenyl)methyl]-5-nitro-2-[(4-oxidanylcyclohexyl)amino]benzamide Openeye Name: N-[(2-chloro-5-methoxy-phenyl)methyl]-2-[(4-hydroxycyclohexyl)amino]-5-nitro-benzamide CAS Name: N-[(2-chloro-5-methoxyphenyl)methyl]-2-[(4-hydroxycyclohexyl)amino]-5-nitrobenzamide IUPAC Name: N-[(2-chloro-5-methoxyphenyl)methyl]-2-[(4-hydroxycyclohexyl)amino]-5-nitrobenzamide Traditional Name: N-(2-chloro-5-methoxy-benzyl)-2-[(4-hydroxycyclohexyl)amino]-5-nitro-benzamide Formula: C21H24ClN3O5 MolecularWeight: 433.88536

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H24ClN3O5/c1-30-17-7-8-19(22)13(10-17)12-23-21(27)18-11-15(25(28)29)4-9-20(18)24-14-2-5-16(26)6-3-14/h4,7-11,14,16,24,26H,2-3,5-6,12H2,1H3,(H,23,27)