1-(2,5-dimethyl-1-propyl-pyrrol-3-yl)-2-(2-nitropyridin-3-yl)oxy-ethanone

Systemtic Name: 1-(2,5-dimethyl-1-propyl-pyrrol-3-yl)-2-(2-nitropyridin-3-yl)oxy-ethanone Openeye Name: 1-(2,5-dimethyl-1-propyl-pyrrol-3-yl)-2-[(2-nitro-3-pyridyl)oxy]ethanone CAS Name: 1-(2,5-dimethyl-1-propyl-3-pyrrolyl)-2-[(2-nitro-3-pyridinyl)oxy]ethanone IUPAC Name: 1-(2,5-dimethyl-1-propylpyrrol-3-yl)-2-(2-nitropyridin-3-yl)oxyethanone Traditional Name: 1-(2,5-dimethyl-1-propyl-pyrrol-3-yl)-2-[(2-nitro-3-pyridyl)oxy]ethanone Formula: C16H19N3O4 MolecularWeight: 317.33976

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=CC(=C1C)C(=O)COC2=C(N=CC=C2)[N+](=O)[O-])C

Isomeric SMILES

CCCN1C(=CC(=C1C)C(=O)COC2=C(N=CC=C2)[N+](=O)[O-])C

InChI

InChI=1S/C16H19N3O4/c1-4-8-18-11(2)9-13(12(18)3)14(20)10-23-15-6-5-7-17-16(15)19(21)22/h5-7,9H,4,8,10H2,1-3H3