4,5-dimethoxy-2-nitro-N-[(4-pyrrolidin-1-ylcarbonylphenyl)methyl]benzamide

Systemtic Name: 4,5-dimethoxy-2-nitro-N-[(4-pyrrolidin-1-ylcarbonylphenyl)methyl]benzamide Openeye Name: 4,5-dimethoxy-2-nitro-N-[[4-(pyrrolidine-1-carbonyl)phenyl]methyl]benzamide CAS Name: 4,5-dimethoxy-2-nitro-N-[[4-[oxo(1-pyrrolidinyl)methyl]phenyl]methyl]benzamide IUPAC Name: 4,5-dimethoxy-2-nitro-N-[[4-(pyrrolidine-1-carbonyl)phenyl]methyl]benzamide Traditional Name: 4,5-dimethoxy-2-nitro-N-[4-(pyrrolidine-1-carbonyl)benzyl]benzamide Formula: C21H23N3O6 MolecularWeight: 413.42382

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)NCC2=CC=C(C=C2)C(=O)N3CCCC3)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)NCC2=CC=C(C=C2)C(=O)N3CCCC3)[N+](=O)[O-])OC

InChI

InChI=1S/C21H23N3O6/c1-29-18-11-16(17(24(27)28)12-19(18)30-2)20(25)22-13-14-5-7-15(8-6-14)21(26)23-9-3-4-10-23/h5-8,11-12H,3-4,9-10,13H2,1-2H3,(H,22,25)