N1,N3-di(cycloheptyl)-5-nitro-benzene-1,3-dicarboxamide

Systemtic Name: N1,N3-di(cycloheptyl)-5-nitro-benzene-1,3-dicarboxamide Openeye Name: N1,N3-di(cycloheptyl)-5-nitro-benzene-1,3-dicarboxamide CAS Name: N1,N3-di(cycloheptyl)-5-nitrobenzene-1,3-dicarboxamide IUPAC Name: 1-N,3-N-di(cycloheptyl)-5-nitrobenzene-1,3-dicarboxamide Traditional Name: N,N'-di(cycloheptyl)-5-nitro-isophthalamide Formula: C22H31N3O4 MolecularWeight: 401.49924

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])C(=O)NC3CCCCCC3

Isomeric SMILES

C1CCCC(CC1)NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])C(=O)NC3CCCCCC3

InChI

InChI=1S/C22H31N3O4/c26-21(23-18-9-5-1-2-6-10-18)16-13-17(15-20(14-16)25(28)29)22(27)24-19-11-7-3-4-8-12-19/h13-15,18-19H,1-12H2,(H,23,26)(H,24,27)