methyl 2,4-dimethyl-5-[2-(3-nitro-4-piperidin-1-yl-phenyl)carbonyloxyethanoyl]-1H-pyrrole-3-carboxylate

Systemtic Name: methyl 2,4-dimethyl-5-[2-(3-nitro-4-piperidin-1-yl-phenyl)carbonyloxyethanoyl]-1H-pyrrole-3-carboxylate Openeye Name: methyl 2,4-dimethyl-5-[2-[3-nitro-4-(1-piperidyl)benzoyl]oxyacetyl]-1H-pyrrole-3-carboxylate CAS Name: 2,4-dimethyl-5-[2-[[3-nitro-4-(1-piperidinyl)phenyl]-oxomethoxy]-1-oxoethyl]-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 2,4-dimethyl-5-[2-(3-nitro-4-piperidin-1-ylbenzoyl)oxyacetyl]-1H-pyrrole-3-carboxylate Traditional Name: 2,4-dimethyl-5-[2-(3-nitro-4-piperidino-benzoyl)oxyacetyl]-1H-pyrrole-3-carboxylic acid methyl ester Formula: C22H25N3O7 MolecularWeight: 443.4498

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)OC)C)C(=O)COC(=O)C2=CC(=C(C=C2)N3CCCCC3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(NC(=C1C(=O)OC)C)C(=O)COC(=O)C2=CC(=C(C=C2)N3CCCCC3)[N+](=O)[O-]

InChI

InChI=1S/C22H25N3O7/c1-13-19(22(28)31-3)14(2)23-20(13)18(26)12-32-21(27)15-7-8-16(17(11-15)25(29)30)24-9-5-4-6-10-24/h7-8,11,23H,4-6,9-10,12H2,1-3H3