4-(1-adamantyl)-N-[(E)-(3-hydroxyphenyl)methylideneamino]quinoline-2-carboxamide

Systemtic Name: 4-(1-adamantyl)-N-[(E)-(3-hydroxyphenyl)methylideneamino]quinoline-2-carboxamide Openeye Name: 4-(1-adamantyl)-N-[(E)-(3-hydroxyphenyl)methyleneamino]quinoline-2-carboxamide CAS Name: 4-(1-adamantyl)-N-[(E)-(3-hydroxyphenyl)methylideneamino]-2-quinolinecarboxamide IUPAC Name: 4-(1-adamantyl)-N-[(E)-(3-hydroxyphenyl)methylideneamino]quinoline-2-carboxamide Traditional Name: 4-(1-adamantyl)-N-[(E)-(3-hydroxybenzylidene)amino]quinaldamide Formula: C27H27N3O2 MolecularWeight: 425.52218

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C4=CC(=NC5=CC=CC=C54)C(=O)NN=CC6=CC(=CC=C6)O

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C4=CC(=NC5=CC=CC=C54)C(=O)N/N=C/C6=CC(=CC=C6)O

InChI

InChI=1S/C27H27N3O2/c31-21-5-3-4-17(11-21)16-28-30-26(32)25-12-23(22-6-1-2-7-24(22)29-25)27-13-18-8-19(14-27)10-20(9-18)15-27/h1-7,11-12,16,18-20,31H,8-10,13-15H2,(H,30,32)/b28-16+