2-[ethoxy(pyridin-3-yl)methyl]-4-methyl-5-nitro-1H-pyrrole-3-carboxylic acid

Systemtic Name: 2-[ethoxy(pyridin-3-yl)methyl]-4-methyl-5-nitro-1H-pyrrole-3-carboxylic acid Openeye Name: 2-[ethoxy(3-pyridyl)methyl]-4-methyl-5-nitro-1H-pyrrole-3-carboxylic acid CAS Name: 2-[ethoxy(3-pyridinyl)methyl]-4-methyl-5-nitro-1H-pyrrole-3-carboxylic acid IUPAC Name: 2-[ethoxy(pyridin-3-yl)methyl]-4-methyl-5-nitro-1H-pyrrole-3-carboxylic acid Traditional Name: 2-[ethoxy(3-pyridyl)methyl]-4-methyl-5-nitro-1H-pyrrole-3-carboxylic acid Formula: C14H15N3O5 MolecularWeight: 305.286

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(C1=CN=CC=C1)C2=C(C(=C(N2)[N+](=O)[O-])C)C(=O)O

Isomeric SMILES

CCOC(C1=CN=CC=C1)C2=C(C(=C(N2)[N+](=O)[O-])C)C(=O)O

InChI

InChI=1S/C14H15N3O5/c1-3-22-12(9-5-4-6-15-7-9)11-10(14(18)19)8(2)13(16-11)17(20)21/h4-7,12,16H,3H2,1-2H3,(H,18,19)