methyl 1-[2-(3-nitropyrrol-1-yl)-2-phenyl-ethanoyl]pyrrolidine-2-carboxylate

Systemtic Name: methyl 1-[2-(3-nitropyrrol-1-yl)-2-phenyl-ethanoyl]pyrrolidine-2-carboxylate Openeye Name: methyl 1-[2-(3-nitropyrrol-1-yl)-2-phenyl-acetyl]pyrrolidine-2-carboxylate CAS Name: 1-[2-(3-nitro-1-pyrrolyl)-1-oxo-2-phenylethyl]-2-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-(3-nitropyrrol-1-yl)-2-phenylacetyl]pyrrolidine-2-carboxylate Traditional Name: 1-[2-(3-nitropyrrol-1-yl)-2-phenyl-acetyl]pyrrolidine-2-carboxylic acid methyl ester Formula: C18H19N3O5 MolecularWeight: 357.36056

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCCN1C(=O)C(C2=CC=CC=C2)N3C=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1CCCN1C(=O)C(C2=CC=CC=C2)N3C=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H19N3O5/c1-26-18(23)15-8-5-10-20(15)17(22)16(13-6-3-2-4-7-13)19-11-9-14(12-19)21(24)25/h2-4,6-7,9,11-12,15-16H,5,8,10H2,1H3