4-(3-bicyclo[3.3.3]undecanyl)-N-(4-nitrophenyl)quinoline-2-carboxamide

Systemtic Name: 4-(3-bicyclo[3.3.3]undecanyl)-N-(4-nitrophenyl)quinoline-2-carboxamide Openeye Name: 4-(3-bicyclo[3.3.3]undecanyl)-N-(4-nitrophenyl)quinoline-2-carboxamide CAS Name: 4-(3-bicyclo[3.3.3]undecanyl)-N-(4-nitrophenyl)-2-quinolinecarboxamide IUPAC Name: 4-(3-bicyclo[3.3.3]undecanyl)-N-(4-nitrophenyl)quinoline-2-carboxamide Traditional Name: 4-(3-bicyclo[3.3.3]undecanyl)-N-(4-nitrophenyl)quinaldamide Formula: C27H29N3O3 MolecularWeight: 443.53746

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2CCCC(C1)CC(C2)C3=CC(=NC4=CC=CC=C43)C(=O)NC5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

C1CC2CCCC(C1)CC(C2)C3=CC(=NC4=CC=CC=C43)C(=O)NC5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C27H29N3O3/c31-27(28-21-11-13-22(14-12-21)30(32)33)26-17-24(23-9-1-2-10-25(23)29-26)20-15-18-5-3-6-19(16-20)8-4-7-18/h1-2,9-14,17-20H,3-8,15-16H2,(H,28,31)