4-(1-adamantyl)-N-[(E)-2,2-dimethylpropylideneamino]quinoline-2-carboxamide

Systemtic Name: 4-(1-adamantyl)-N-[(E)-2,2-dimethylpropylideneamino]quinoline-2-carboxamide Openeye Name: 4-(1-adamantyl)-N-[(E)-2,2-dimethylpropylideneamino]quinoline-2-carboxamide CAS Name: 4-(1-adamantyl)-N-[(E)-2,2-dimethylpropylideneamino]-2-quinolinecarboxamide IUPAC Name: 4-(1-adamantyl)-N-[(E)-2,2-dimethylpropylideneamino]quinoline-2-carboxamide Traditional Name: 4-(1-adamantyl)-N-[(E)-neopentylideneamino]quinaldamide Formula: C25H31N3O MolecularWeight: 389.53314

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C=NNC(=O)C1=NC2=CC=CC=C2C(=C1)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC(C)(C)/C=N/NC(=O)C1=NC2=CC=CC=C2C(=C1)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C25H31N3O/c1-24(2,3)15-26-28-23(29)22-11-20(19-6-4-5-7-21(19)27-22)25-12-16-8-17(13-25)10-18(9-16)14-25/h4-7,11,15-18H,8-10,12-14H2,1-3H3,(H,28,29)/b26-15+