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

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

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