4-ethanoyl-3,5-dimethyl-N-[2-(4-nitrophenyl)-2-oxidanyl-ethyl]-1H-pyrrole-2-carboxamide

Systemtic Name: 4-ethanoyl-3,5-dimethyl-N-[2-(4-nitrophenyl)-2-oxidanyl-ethyl]-1H-pyrrole-2-carboxamide Openeye Name: 4-acetyl-N-[2-hydroxy-2-(4-nitrophenyl)ethyl]-3,5-dimethyl-1H-pyrrole-2-carboxamide CAS Name: 4-acetyl-N-[2-hydroxy-2-(4-nitrophenyl)ethyl]-3,5-dimethyl-1H-pyrrole-2-carboxamide IUPAC Name: 4-acetyl-N-[2-hydroxy-2-(4-nitrophenyl)ethyl]-3,5-dimethyl-1H-pyrrole-2-carboxamide Traditional Name: 4-acetyl-N-[2-hydroxy-2-(4-nitrophenyl)ethyl]-3,5-dimethyl-1H-pyrrole-2-carboxamide Formula: C17H19N3O5 MolecularWeight: 345.34986

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)C)C)C(=O)NCC(C2=CC=C(C=C2)[N+](=O)[O-])O

Isomeric SMILES

CC1=C(NC(=C1C(=O)C)C)C(=O)NCC(C2=CC=C(C=C2)[N+](=O)[O-])O

InChI

InChI=1S/C17H19N3O5/c1-9-15(11(3)21)10(2)19-16(9)17(23)18-8-14(22)12-4-6-13(7-5-12)20(24)25/h4-7,14,19,22H,8H2,1-3H3,(H,18,23)