N-[2-(2,5-dihydropyrrol-1-yl)-5-oxidanylidene-cyclooctyl]-N-methyl-3-nitro-benzamide

Systemtic Name: N-[2-(2,5-dihydropyrrol-1-yl)-5-oxidanylidene-cyclooctyl]-N-methyl-3-nitro-benzamide Openeye Name: N-[2-(2,5-dihydropyrrol-1-yl)-5-oxo-cyclooctyl]-N-methyl-3-nitro-benzamide CAS Name: N-[2-(2,5-dihydropyrrol-1-yl)-5-oxocyclooctyl]-N-methyl-3-nitrobenzamide IUPAC Name: N-[2-(2,5-dihydropyrrol-1-yl)-5-oxocyclooctyl]-N-methyl-3-nitrobenzamide Traditional Name: N-[5-keto-2-(3-pyrrolin-1-yl)cyclooctyl]-N-methyl-3-nitro-benzamide Formula: C20H25N3O4 MolecularWeight: 371.4302

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCCC(=O)CCC1N2CC=CC2)C(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CN(C1CCCC(=O)CCC1N2CC=CC2)C(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H25N3O4/c1-21(20(25)15-6-4-7-16(14-15)23(26)27)18-9-5-8-17(24)10-11-19(18)22-12-2-3-13-22/h2-4,6-7,14,18-19H,5,8-13H2,1H3