4-ethanoyl-3,5-dimethyl-N-(4-methyl-3-nitro-phenyl)-1H-pyrrole-2-carboxamide

Systemtic Name: 4-ethanoyl-3,5-dimethyl-N-(4-methyl-3-nitro-phenyl)-1H-pyrrole-2-carboxamide Openeye Name: 4-acetyl-3,5-dimethyl-N-(4-methyl-3-nitro-phenyl)-1H-pyrrole-2-carboxamide CAS Name: 4-acetyl-3,5-dimethyl-N-(4-methyl-3-nitrophenyl)-1H-pyrrole-2-carboxamide IUPAC Name: 4-acetyl-3,5-dimethyl-N-(4-methyl-3-nitrophenyl)-1H-pyrrole-2-carboxamide Traditional Name: 4-acetyl-3,5-dimethyl-N-(4-methyl-3-nitro-phenyl)-1H-pyrrole-2-carboxamide Formula: C16H17N3O4 MolecularWeight: 315.32388

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=C(C(=C(N2)C)C(=O)C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=C(C(=C(N2)C)C(=O)C)C)[N+](=O)[O-]

InChI

InChI=1S/C16H17N3O4/c1-8-5-6-12(7-13(8)19(22)23)18-16(21)15-9(2)14(11(4)20)10(3)17-15/h5-7,17H,1-4H3,(H,18,21)