azepan-1-yl-[2-(3-propan-2-yloxyphenyl)quinolin-4-yl]methanone

Systemtic Name: azepan-1-yl-[2-(3-propan-2-yloxyphenyl)quinolin-4-yl]methanone Openeye Name: azepan-1-yl-[2-(3-isopropoxyphenyl)-4-quinolyl]methanone CAS Name: 1-azepanyl-[2-(3-propan-2-yloxyphenyl)-4-quinolinyl]methanone IUPAC Name: azepan-1-yl-[2-(3-propan-2-yloxyphenyl)quinolin-4-yl]methanone Traditional Name: azepan-1-yl-[2-(3-isopropoxyphenyl)-4-quinolyl]methanone Formula: C25H28N2O2 MolecularWeight: 388.50202

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=CC(=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)N4CCCCCC4

Isomeric SMILES

CC(C)OC1=CC=CC(=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)N4CCCCCC4

InChI

InChI=1S/C25H28N2O2/c1-18(2)29-20-11-9-10-19(16-20)24-17-22(21-12-5-6-13-23(21)26-24)25(28)27-14-7-3-4-8-15-27/h5-6,9-13,16-18H,3-4,7-8,14-15H2,1-2H3