N-(1-adamantyl)-7-ethoxy-4-oxidanylidene-1-pentyl-quinoline-3-carboxamide

Systemtic Name: N-(1-adamantyl)-7-ethoxy-4-oxidanylidene-1-pentyl-quinoline-3-carboxamide Openeye Name: N-(1-adamantyl)-7-ethoxy-4-oxo-1-pentyl-quinoline-3-carboxamide CAS Name: N-(1-adamantyl)-7-ethoxy-4-oxo-1-pentyl-3-quinolinecarboxamide IUPAC Name: N-(1-adamantyl)-7-ethoxy-4-oxo-1-pentylquinoline-3-carboxamide Traditional Name: N-(1-adamantyl)-1-amyl-7-ethoxy-4-keto-quinoline-3-carboxamide Formula: C27H36N2O3 MolecularWeight: 436.58634

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H36N2O3/c1-3-5-6-9-29-17-23(25(30)22-8-7-21(32-4-2)13-24(22)29)26(31)28-27-14-18-10-19(15-27)12-20(11-18)16-27/h7-8,13,17-20H,3-6,9-12,14-16H2,1-2H3,(H,28,31)