N-[1-(1-adamantyl)ethyl]-7-chloranyl-4-oxidanylidene-1-pentyl-quinoline-3-carboxamide

Systemtic Name: N-[1-(1-adamantyl)ethyl]-7-chloranyl-4-oxidanylidene-1-pentyl-quinoline-3-carboxamide Openeye Name: N-[1-(1-adamantyl)ethyl]-7-chloro-4-oxo-1-pentyl-quinoline-3-carboxamide CAS Name: N-[1-(1-adamantyl)ethyl]-7-chloro-4-oxo-1-pentyl-3-quinolinecarboxamide IUPAC Name: N-[1-(1-adamantyl)ethyl]-7-chloro-4-oxo-1-pentylquinoline-3-carboxamide Traditional Name: N-[1-(1-adamantyl)ethyl]-1-amyl-7-chloro-4-keto-quinoline-3-carboxamide Formula: C27H35ClN2O2 MolecularWeight: 455.032

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C=C(C(=O)C2=C1C=C(C=C2)Cl)C(=O)NC(C)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CCCCCN1C=C(C(=O)C2=C1C=C(C=C2)Cl)C(=O)NC(C)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C27H35ClN2O2/c1-3-4-5-8-30-16-23(25(31)22-7-6-21(28)12-24(22)30)26(32)29-17(2)27-13-18-9-19(14-27)11-20(10-18)15-27/h6-7,12,16-20H,3-5,8-11,13-15H2,1-2H3,(H,29,32)