N-[2-[2,5-bis(chloranyl)phenyl]-1,3-benzoxazol-5-yl]-3-nitro-4-pyrrolidin-1-yl-benzamide

Systemtic Name: N-[2-[2,5-bis(chloranyl)phenyl]-1,3-benzoxazol-5-yl]-3-nitro-4-pyrrolidin-1-yl-benzamide Openeye Name: N-[2-(2,5-dichlorophenyl)-1,3-benzoxazol-5-yl]-3-nitro-4-pyrrolidin-1-yl-benzamide CAS Name: N-[2-(2,5-dichlorophenyl)-1,3-benzoxazol-5-yl]-3-nitro-4-(1-pyrrolidinyl)benzamide IUPAC Name: N-[2-(2,5-dichlorophenyl)-1,3-benzoxazol-5-yl]-3-nitro-4-pyrrolidin-1-ylbenzamide Traditional Name: N-[2-(2,5-dichlorophenyl)-1,3-benzoxazol-5-yl]-3-nitro-4-pyrrolidino-benzamide Formula: C24H18Cl2N4O4 MolecularWeight: 497.33012

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=C(C=C2)C(=O)NC3=CC4=C(C=C3)OC(=N4)C5=C(C=CC(=C5)Cl)Cl)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C=C2)C(=O)NC3=CC4=C(C=C3)OC(=N4)C5=C(C=CC(=C5)Cl)Cl)[N+](=O)[O-]

InChI

InChI=1S/C24H18Cl2N4O4/c25-15-4-6-18(26)17(12-15)24-28-19-13-16(5-8-22(19)34-24)27-23(31)14-3-7-20(21(11-14)30(32)33)29-9-1-2-10-29/h3-8,11-13H,1-2,9-10H2,(H,27,31)