N-[4-[4-(azepan-1-ylcarbonyl)-6-methyl-quinolin-2-yl]phenyl]ethanamide

Systemtic Name: N-[4-[4-(azepan-1-ylcarbonyl)-6-methyl-quinolin-2-yl]phenyl]ethanamide Openeye Name: N-[4-[4-(azepane-1-carbonyl)-6-methyl-2-quinolyl]phenyl]acetamide CAS Name: N-[4-[4-[1-azepanyl(oxo)methyl]-6-methyl-2-quinolinyl]phenyl]acetamide IUPAC Name: N-[4-[4-(azepane-1-carbonyl)-6-methylquinolin-2-yl]phenyl]acetamide Traditional Name: N-[4-[4-(azepane-1-carbonyl)-6-methyl-2-quinolyl]phenyl]acetamide Formula: C25H27N3O2 MolecularWeight: 401.50078

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(C=C2C(=O)N3CCCCCC3)C4=CC=C(C=C4)NC(=O)C

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(C=C2C(=O)N3CCCCCC3)C4=CC=C(C=C4)NC(=O)C

InChI

InChI=1S/C25H27N3O2/c1-17-7-12-23-21(15-17)22(25(30)28-13-5-3-4-6-14-28)16-24(27-23)19-8-10-20(11-9-19)26-18(2)29/h7-12,15-16H,3-6,13-14H2,1-2H3,(H,26,29)