ethyl 3-[[4-(1H-benzimidazol-2-yl)phenyl]carbamoyl]-5-nitro-benzoate

Systemtic Name: ethyl 3-[[4-(1H-benzimidazol-2-yl)phenyl]carbamoyl]-5-nitro-benzoate Openeye Name: ethyl 3-[[4-(1H-benzimidazol-2-yl)phenyl]carbamoyl]-5-nitro-benzoate CAS Name: 3-[[4-(1H-benzimidazol-2-yl)anilino]-oxomethyl]-5-nitrobenzoic acid ethyl ester IUPAC Name: ethyl 3-[[4-(1H-benzimidazol-2-yl)phenyl]carbamoyl]-5-nitrobenzoate Traditional Name: 3-[[4-(1H-benzimidazol-2-yl)phenyl]carbamoyl]-5-nitro-benzoic acid ethyl ester Formula: C23H18N4O5 MolecularWeight: 430.41282

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1)C(=O)NC2=CC=C(C=C2)C3=NC4=CC=CC=C4N3)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)C(=O)NC2=CC=C(C=C2)C3=NC4=CC=CC=C4N3)[N+](=O)[O-]

InChI

InChI=1S/C23H18N4O5/c1-2-32-23(29)16-11-15(12-18(13-16)27(30)31)22(28)24-17-9-7-14(8-10-17)21-25-19-5-3-4-6-20(19)26-21/h3-13H,2H2,1H3,(H,24,28)(H,25,26)