N-[2-[2-(hydroxymethyl)pyrrolidin-1-yl]-5-nitro-phenyl]ethanamide

Systemtic Name: N-[2-[2-(hydroxymethyl)pyrrolidin-1-yl]-5-nitro-phenyl]ethanamide Openeye Name: N-[2-[2-(hydroxymethyl)pyrrolidin-1-yl]-5-nitro-phenyl]acetamide CAS Name: N-[2-[2-(hydroxymethyl)-1-pyrrolidinyl]-5-nitrophenyl]acetamide IUPAC Name: N-[2-[2-(hydroxymethyl)pyrrolidin-1-yl]-5-nitrophenyl]acetamide Traditional Name: N-[2-(2-methylolpyrrolidino)-5-nitro-phenyl]acetamide Formula: C13H17N3O4 MolecularWeight: 279.29178

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=CC(=C1)[N+](=O)[O-])N2CCCC2CO

Isomeric SMILES

CC(=O)NC1=C(C=CC(=C1)[N+](=O)[O-])N2CCCC2CO

InChI

InChI=1S/C13H17N3O4/c1-9(18)14-12-7-10(16(19)20)4-5-13(12)15-6-2-3-11(15)8-17/h4-5,7,11,17H,2-3,6,8H2,1H3,(H,14,18)