N-(3-chloranyl-4-pyrrolidin-1-yl-phenyl)-5-(2-methyl-4-nitro-phenyl)furan-2-carboxamide

Systemtic Name: N-(3-chloranyl-4-pyrrolidin-1-yl-phenyl)-5-(2-methyl-4-nitro-phenyl)furan-2-carboxamide Openeye Name: N-(3-chloro-4-pyrrolidin-1-yl-phenyl)-5-(2-methyl-4-nitro-phenyl)furan-2-carboxamide CAS Name: N-[3-chloro-4-(1-pyrrolidinyl)phenyl]-5-(2-methyl-4-nitrophenyl)-2-furancarboxamide IUPAC Name: N-(3-chloro-4-pyrrolidin-1-ylphenyl)-5-(2-methyl-4-nitrophenyl)furan-2-carboxamide Traditional Name: N-(3-chloro-4-pyrrolidino-phenyl)-5-(2-methyl-4-nitro-phenyl)-2-furamide Formula: C22H20ClN3O4 MolecularWeight: 425.8649

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)[N+](=O)[O-])C2=CC=C(O2)C(=O)NC3=CC(=C(C=C3)N4CCCC4)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)[N+](=O)[O-])C2=CC=C(O2)C(=O)NC3=CC(=C(C=C3)N4CCCC4)Cl

InChI

InChI=1S/C22H20ClN3O4/c1-14-12-16(26(28)29)5-6-17(14)20-8-9-21(30-20)22(27)24-15-4-7-19(18(23)13-15)25-10-2-3-11-25/h4-9,12-13H,2-3,10-11H2,1H3,(H,24,27)