6-[[1-(2-cinnolin-5-yloxyethyl)piperidin-4-yl]methyl]-4H-1,4-benzoxazin-3-one

Systemtic Name: 6-[[1-(2-cinnolin-5-yloxyethyl)piperidin-4-yl]methyl]-4H-1,4-benzoxazin-3-one Openeye Name: 6-[[1-(2-cinnolin-5-yloxyethyl)-4-piperidyl]methyl]-4H-1,4-benzoxazin-3-one CAS Name: 6-[[1-[2-(5-cinnolinyloxy)ethyl]-4-piperidinyl]methyl]-4H-1,4-benzoxazin-3-one IUPAC Name: 6-[[1-(2-cinnolin-5-yloxyethyl)piperidin-4-yl]methyl]-4H-1,4-benzoxazin-3-one Traditional Name: 6-[[1-(2-cinnolin-5-yloxyethyl)-4-piperidyl]methyl]-4H-1,4-benzoxazin-3-one Formula: C24H26N4O3 MolecularWeight: 418.48824

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC3=C(C=C2)OCC(=O)N3)CCOC4=CC=CC5=C4C=CN=N5

Isomeric SMILES

C1CN(CCC1CC2=CC3=C(C=C2)OCC(=O)N3)CCOC4=CC=CC5=C4C=CN=N5

InChI

InChI=1S/C24H26N4O3/c29-24-16-31-23-5-4-18(15-21(23)26-24)14-17-7-10-28(11-8-17)12-13-30-22-3-1-2-20-19(22)6-9-25-27-20/h1-6,9,15,17H,7-8,10-14,16H2,(H,26,29)