3-(3-imidazol-1-ylphenyl)-N-(2-nitro-5-pyrrol-1-yl-phenyl)-3-oxidanylidene-propanamide

Systemtic Name: 3-(3-imidazol-1-ylphenyl)-N-(2-nitro-5-pyrrol-1-yl-phenyl)-3-oxidanylidene-propanamide Openeye Name: 3-(3-imidazol-1-ylphenyl)-N-(2-nitro-5-pyrrol-1-yl-phenyl)-3-oxo-propanamide CAS Name: 3-[3-(1-imidazolyl)phenyl]-N-[2-nitro-5-(1-pyrrolyl)phenyl]-3-oxopropanamide IUPAC Name: 3-(3-imidazol-1-ylphenyl)-N-(2-nitro-5-pyrrol-1-ylphenyl)-3-oxopropanamide Traditional Name: 3-(3-imidazol-1-ylphenyl)-3-keto-N-(2-nitro-5-pyrrol-1-yl-phenyl)propionamide Formula: C22H17N5O4 MolecularWeight: 415.40148

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(C=C1)C2=CC(=C(C=C2)[N+](=O)[O-])NC(=O)CC(=O)C3=CC(=CC=C3)N4C=CN=C4

Isomeric SMILES

C1=CN(C=C1)C2=CC(=C(C=C2)[N+](=O)[O-])NC(=O)CC(=O)C3=CC(=CC=C3)N4C=CN=C4

InChI

InChI=1S/C22H17N5O4/c28-21(16-4-3-5-17(12-16)26-11-8-23-15-26)14-22(29)24-19-13-18(25-9-1-2-10-25)6-7-20(19)27(30)31/h1-13,15H,14H2,(H,24,29)