[3-(hydroxymethyl)piperidin-1-yl]-(3-methyl-2-nitro-phenyl)methanone

Systemtic Name: [3-(hydroxymethyl)piperidin-1-yl]-(3-methyl-2-nitro-phenyl)methanone Openeye Name: [3-(hydroxymethyl)-1-piperidyl]-(3-methyl-2-nitro-phenyl)methanone CAS Name: [3-(hydroxymethyl)-1-piperidinyl]-(3-methyl-2-nitrophenyl)methanone IUPAC Name: [3-(hydroxymethyl)piperidin-1-yl]-(3-methyl-2-nitrophenyl)methanone Traditional Name: (3-methyl-2-nitro-phenyl)-(3-methylolpiperidino)methanone Formula: C14H18N2O4 MolecularWeight: 278.30372

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1[N+](=O)[O-])C(=O)N2CCCC(C2)CO

Isomeric SMILES

CC1=CC=CC(=C1[N+](=O)[O-])C(=O)N2CCCC(C2)CO

InChI

InChI=1S/C14H18N2O4/c1-10-4-2-6-12(13(10)16(19)20)14(18)15-7-3-5-11(8-15)9-17/h2,4,6,11,17H,3,5,7-9H2,1H3