1-methyl-4-nitro-N-(2-oxidanyl-2-phenyl-ethyl)pyrrole-2-carboxamide

Systemtic Name: 1-methyl-4-nitro-N-(2-oxidanyl-2-phenyl-ethyl)pyrrole-2-carboxamide Openeye Name: N-(2-hydroxy-2-phenyl-ethyl)-1-methyl-4-nitro-pyrrole-2-carboxamide CAS Name: N-(2-hydroxy-2-phenylethyl)-1-methyl-4-nitro-2-pyrrolecarboxamide IUPAC Name: N-(2-hydroxy-2-phenylethyl)-1-methyl-4-nitropyrrole-2-carboxamide Traditional Name: N-(2-hydroxy-2-phenyl-ethyl)-1-methyl-4-nitro-pyrrole-2-carboxamide Formula: C14H15N3O4 MolecularWeight: 289.2866

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)NCC(C2=CC=CC=C2)O)[N+](=O)[O-]

Isomeric SMILES

CN1C=C(C=C1C(=O)NCC(C2=CC=CC=C2)O)[N+](=O)[O-]

InChI

InChI=1S/C14H15N3O4/c1-16-9-11(17(20)21)7-12(16)14(19)15-8-13(18)10-5-3-2-4-6-10/h2-7,9,13,18H,8H2,1H3,(H,15,19)