3-[(1-adamantylamino)methyl]-1-pentyl-quinolin-4-one

Systemtic Name: 3-[(1-adamantylamino)methyl]-1-pentyl-quinolin-4-one Openeye Name: 3-[(1-adamantylamino)methyl]-1-pentyl-quinolin-4-one CAS Name: 3-[(1-adamantylamino)methyl]-1-pentyl-4-quinolinone IUPAC Name: 3-[(1-adamantylamino)methyl]-1-pentylquinolin-4-one Traditional Name: 3-[(1-adamantylamino)methyl]-1-amyl-4-quinolone Formula: C25H34N2O MolecularWeight: 378.55026

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C=C(C(=O)C2=CC=CC=C21)CNC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CCCCCN1C=C(C(=O)C2=CC=CC=C21)CNC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C25H34N2O/c1-2-3-6-9-27-17-21(24(28)22-7-4-5-8-23(22)27)16-26-25-13-18-10-19(14-25)12-20(11-18)15-25/h4-5,7-8,17-20,26H,2-3,6,9-16H2,1H3