N-(1-adamantyl)-7-chloranyl-8-methyl-4-oxidanylidene-1-pentyl-quinoline-3-carboxamide

Systemtic Name: N-(1-adamantyl)-7-chloranyl-8-methyl-4-oxidanylidene-1-pentyl-quinoline-3-carboxamide Openeye Name: N-(1-adamantyl)-7-chloro-8-methyl-4-oxo-1-pentyl-quinoline-3-carboxamide CAS Name: N-(1-adamantyl)-7-chloro-8-methyl-4-oxo-1-pentyl-3-quinolinecarboxamide IUPAC Name: N-(1-adamantyl)-7-chloro-8-methyl-4-oxo-1-pentylquinoline-3-carboxamide Traditional Name: N-(1-adamantyl)-1-amyl-7-chloro-4-keto-8-methyl-quinoline-3-carboxamide Formula: C26H33ClN2O2 MolecularWeight: 441.00542

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C=C(C(=O)C2=C1C(=C(C=C2)Cl)C)C(=O)NC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CCCCCN1C=C(C(=O)C2=C1C(=C(C=C2)Cl)C)C(=O)NC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C26H33ClN2O2/c1-3-4-5-8-29-15-21(24(30)20-6-7-22(27)16(2)23(20)29)25(31)28-26-12-17-9-18(13-26)11-19(10-17)14-26/h6-7,15,17-19H,3-5,8-14H2,1-2H3,(H,28,31)