methyl 3-(1-methylpyrrol-2-yl)-4-nitro-butanoate

Systemtic Name: methyl 3-(1-methylpyrrol-2-yl)-4-nitro-butanoate Openeye Name: methyl 3-(1-methylpyrrol-2-yl)-4-nitro-butanoate CAS Name: 3-(1-methyl-2-pyrrolyl)-4-nitrobutanoic acid methyl ester IUPAC Name: methyl 3-(1-methylpyrrol-2-yl)-4-nitrobutanoate Traditional Name: 3-(1-methylpyrrol-2-yl)-4-nitro-butyric acid methyl ester Formula: C10H14N2O4 MolecularWeight: 226.22916

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C(CC(=O)OC)C[N+](=O)[O-]

Isomeric SMILES

CN1C=CC=C1C(CC(=O)OC)C[N+](=O)[O-]

InChI

InChI=1S/C10H14N2O4/c1-11-5-3-4-9(11)8(7-12(14)15)6-10(13)16-2/h3-5,8H,6-7H2,1-2H3