4-(2-adamantyl)-N-(phenylmethyl)quinoline-2-carboxamide

Systemtic Name: 4-(2-adamantyl)-N-(phenylmethyl)quinoline-2-carboxamide Openeye Name: 4-(2-adamantyl)-N-benzyl-quinoline-2-carboxamide CAS Name: 4-(2-adamantyl)-N-(phenylmethyl)-2-quinolinecarboxamide IUPAC Name: 4-(2-adamantyl)-N-benzylquinoline-2-carboxamide Traditional Name: 4-(2-adamantyl)-N-benzyl-quinaldamide Formula: C27H28N2O MolecularWeight: 396.52402

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)C3C4=CC(=NC5=CC=CC=C54)C(=O)NCC6=CC=CC=C6

Isomeric SMILES

C1C2CC3CC1CC(C2)C3C4=CC(=NC5=CC=CC=C54)C(=O)NCC6=CC=CC=C6

InChI

InChI=1S/C27H28N2O/c30-27(28-16-17-6-2-1-3-7-17)25-15-23(22-8-4-5-9-24(22)29-25)26-20-11-18-10-19(13-20)14-21(26)12-18/h1-9,15,18-21,26H,10-14,16H2,(H,28,30)