4,5-dimethoxy-2-nitro-N-[3-(4-pyrrolidin-1-ylphenyl)propyl]benzamide

Systemtic Name: 4,5-dimethoxy-2-nitro-N-[3-(4-pyrrolidin-1-ylphenyl)propyl]benzamide Openeye Name: 4,5-dimethoxy-2-nitro-N-[3-(4-pyrrolidin-1-ylphenyl)propyl]benzamide CAS Name: 4,5-dimethoxy-2-nitro-N-[3-[4-(1-pyrrolidinyl)phenyl]propyl]benzamide IUPAC Name: 4,5-dimethoxy-2-nitro-N-[3-(4-pyrrolidin-1-ylphenyl)propyl]benzamide Traditional Name: 4,5-dimethoxy-2-nitro-N-[3-(4-pyrrolidinophenyl)propyl]benzamide Formula: C22H27N3O5 MolecularWeight: 413.46688

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)NCCCC2=CC=C(C=C2)N3CCCC3)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)NCCCC2=CC=C(C=C2)N3CCCC3)[N+](=O)[O-])OC

InChI

InChI=1S/C22H27N3O5/c1-29-20-14-18(19(25(27)28)15-21(20)30-2)22(26)23-11-5-6-16-7-9-17(10-8-16)24-12-3-4-13-24/h7-10,14-15H,3-6,11-13H2,1-2H3,(H,23,26)