2-(cyclopentylamino)-N-[(3-methoxy-4-oxidanyl-phenyl)methyl]-5-nitro-benzamide

Systemtic Name: 2-(cyclopentylamino)-N-[(3-methoxy-4-oxidanyl-phenyl)methyl]-5-nitro-benzamide Openeye Name: 2-(cyclopentylamino)-N-[(4-hydroxy-3-methoxy-phenyl)methyl]-5-nitro-benzamide CAS Name: 2-(cyclopentylamino)-N-[(4-hydroxy-3-methoxyphenyl)methyl]-5-nitrobenzamide IUPAC Name: 2-(cyclopentylamino)-N-[(4-hydroxy-3-methoxyphenyl)methyl]-5-nitrobenzamide Traditional Name: 2-(cyclopentylamino)-5-nitro-N-vanillyl-benzamide Formula: C20H23N3O5 MolecularWeight: 385.41372

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CNC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])NC3CCCC3)O

Isomeric SMILES

COC1=C(C=CC(=C1)CNC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])NC3CCCC3)O

InChI

InChI=1S/C20H23N3O5/c1-28-19-10-13(6-9-18(19)24)12-21-20(25)16-11-15(23(26)27)7-8-17(16)22-14-4-2-3-5-14/h6-11,14,22,24H,2-5,12H2,1H3,(H,21,25)