N-(4-chloranyl-2,5-dimethoxy-phenyl)-3-nitro-4-pyrrolidin-1-yl-benzamide

Systemtic Name: N-(4-chloranyl-2,5-dimethoxy-phenyl)-3-nitro-4-pyrrolidin-1-yl-benzamide Openeye Name: N-(4-chloro-2,5-dimethoxy-phenyl)-3-nitro-4-pyrrolidin-1-yl-benzamide CAS Name: N-(4-chloro-2,5-dimethoxyphenyl)-3-nitro-4-(1-pyrrolidinyl)benzamide IUPAC Name: N-(4-chloro-2,5-dimethoxyphenyl)-3-nitro-4-pyrrolidin-1-ylbenzamide Traditional Name: N-(4-chloro-2,5-dimethoxy-phenyl)-3-nitro-4-pyrrolidino-benzamide Formula: C19H20ClN3O5 MolecularWeight: 405.8322

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1NC(=O)C2=CC(=C(C=C2)N3CCCC3)[N+](=O)[O-])OC)Cl

Isomeric SMILES

COC1=CC(=C(C=C1NC(=O)C2=CC(=C(C=C2)N3CCCC3)[N+](=O)[O-])OC)Cl

InChI

InChI=1S/C19H20ClN3O5/c1-27-17-11-14(18(28-2)10-13(17)20)21-19(24)12-5-6-15(16(9-12)23(25)26)22-7-3-4-8-22/h5-6,9-11H,3-4,7-8H2,1-2H3,(H,21,24)