2-(3-methylpiperidin-1-yl)-1-(4-nitro-1H-pyrrol-2-yl)ethanone

Systemtic Name: 2-(3-methylpiperidin-1-yl)-1-(4-nitro-1H-pyrrol-2-yl)ethanone Openeye Name: 2-(3-methyl-1-piperidyl)-1-(4-nitro-1H-pyrrol-2-yl)ethanone CAS Name: 2-(3-methyl-1-piperidinyl)-1-(4-nitro-1H-pyrrol-2-yl)ethanone IUPAC Name: 2-(3-methylpiperidin-1-yl)-1-(4-nitro-1H-pyrrol-2-yl)ethanone Traditional Name: 2-(3-methylpiperidino)-1-(4-nitro-1H-pyrrol-2-yl)ethanone Formula: C12H17N3O3 MolecularWeight: 251.28168

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)CC(=O)C2=CC(=CN2)[N+](=O)[O-]

Isomeric SMILES

CC1CCCN(C1)CC(=O)C2=CC(=CN2)[N+](=O)[O-]

InChI

InChI=1S/C12H17N3O3/c1-9-3-2-4-14(7-9)8-12(16)11-5-10(6-13-11)15(17)18/h5-6,9,13H,2-4,7-8H2,1H3