N-[3-[(7-chloranylquinolin-4-yl)amino]propyl]adamantane-1-carboxamide

Systemtic Name: N-[3-[(7-chloranylquinolin-4-yl)amino]propyl]adamantane-1-carboxamide Openeye Name: N-[3-[(7-chloro-4-quinolyl)amino]propyl]adamantane-1-carboxamide CAS Name: N-[3-[(7-chloro-4-quinolinyl)amino]propyl]-1-adamantanecarboxamide IUPAC Name: N-[3-[(7-chloroquinolin-4-yl)amino]propyl]adamantane-1-carboxamide Traditional Name: N-[3-[(7-chloro-4-quinolyl)amino]propyl]adamantane-1-carboxamide Formula: C23H28ClN3O MolecularWeight: 397.94092

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)NCCCNC4=C5C=CC(=CC5=NC=C4)Cl

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)NCCCNC4=C5C=CC(=CC5=NC=C4)Cl

InChI

InChI=1S/C23H28ClN3O/c24-18-2-3-19-20(4-7-26-21(19)11-18)25-5-1-6-27-22(28)23-12-15-8-16(13-23)10-17(9-15)14-23/h2-4,7,11,15-17H,1,5-6,8-10,12-14H2,(H,25,26)(H,27,28)