1-[4-(hydroxymethyl)-2-nitro-phenyl]pyrrolidine-2-carboxamide

Systemtic Name: 1-[4-(hydroxymethyl)-2-nitro-phenyl]pyrrolidine-2-carboxamide Openeye Name: 1-[4-(hydroxymethyl)-2-nitro-phenyl]pyrrolidine-2-carboxamide CAS Name: 1-[4-(hydroxymethyl)-2-nitrophenyl]-2-pyrrolidinecarboxamide IUPAC Name: 1-[4-(hydroxymethyl)-2-nitrophenyl]pyrrolidine-2-carboxamide Traditional Name: 1-(4-methylol-2-nitro-phenyl)pyrrolidine-2-carboxamide Formula: C12H15N3O4 MolecularWeight: 265.2652

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C2=C(C=C(C=C2)CO)[N+](=O)[O-])C(=O)N

Isomeric SMILES

C1CC(N(C1)C2=C(C=C(C=C2)CO)[N+](=O)[O-])C(=O)N

InChI

InChI=1S/C12H15N3O4/c13-12(17)10-2-1-5-14(10)9-4-3-8(7-16)6-11(9)15(18)19/h3-4,6,10,16H,1-2,5,7H2,(H2,13,17)