N-(3,5-dimethylphenyl)-1-(3,5-dinitrophenyl)carbonyl-pyrrolidine-2-carboxamide

Systemtic Name: N-(3,5-dimethylphenyl)-1-(3,5-dinitrophenyl)carbonyl-pyrrolidine-2-carboxamide Openeye Name: N-(3,5-dimethylphenyl)-1-(3,5-dinitrobenzoyl)pyrrolidine-2-carboxamide CAS Name: N-(3,5-dimethylphenyl)-1-[(3,5-dinitrophenyl)-oxomethyl]-2-pyrrolidinecarboxamide IUPAC Name: N-(3,5-dimethylphenyl)-1-(3,5-dinitrobenzoyl)pyrrolidine-2-carboxamide Traditional Name: N-(3,5-dimethylphenyl)-1-(3,5-dinitrobenzoyl)pyrrolidine-2-carboxamide Formula: C20H20N4O6 MolecularWeight: 412.396

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=O)C2CCCN2C(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=O)C2CCCN2C(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-])C

InChI

InChI=1S/C20H20N4O6/c1-12-6-13(2)8-15(7-12)21-19(25)18-4-3-5-22(18)20(26)14-9-16(23(27)28)11-17(10-14)24(29)30/h6-11,18H,3-5H2,1-2H3,(H,21,25)