2-[1-(3,4-dimethoxyphenyl)-2-nitro-ethyl]-1H-pyrrole

Systemtic Name: 2-[1-(3,4-dimethoxyphenyl)-2-nitro-ethyl]-1H-pyrrole Openeye Name: 2-[1-(3,4-dimethoxyphenyl)-2-nitro-ethyl]-1H-pyrrole CAS Name: 2-[1-(3,4-dimethoxyphenyl)-2-nitroethyl]-1H-pyrrole IUPAC Name: 2-[1-(3,4-dimethoxyphenyl)-2-nitroethyl]-1H-pyrrole Traditional Name: 2-[1-(3,4-dimethoxyphenyl)-2-nitro-ethyl]-1H-pyrrole Formula: C14H16N2O4 MolecularWeight: 276.28784

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(C[N+](=O)[O-])C2=CC=CN2)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(C[N+](=O)[O-])C2=CC=CN2)OC

InChI

InChI=1S/C14H16N2O4/c1-19-13-6-5-10(8-14(13)20-2)11(9-16(17)18)12-4-3-7-15-12/h3-8,11,15H,9H2,1-2H3