6-[[[1-[2-(6-methoxyquinolin-4-yl)-2-oxidanyl-ethyl]piperidin-2-yl]methylamino]methyl]-4H-1,4-benzoxazin-3-one

Systemtic Name: 6-[[[1-[2-(6-methoxyquinolin-4-yl)-2-oxidanyl-ethyl]piperidin-2-yl]methylamino]methyl]-4H-1,4-benzoxazin-3-one Openeye Name: 6-[[[1-[2-hydroxy-2-(6-methoxy-4-quinolyl)ethyl]-2-piperidyl]methylamino]methyl]-4H-1,4-benzoxazin-3-one CAS Name: 6-[[[1-[2-hydroxy-2-(6-methoxy-4-quinolinyl)ethyl]-2-piperidinyl]methylamino]methyl]-4H-1,4-benzoxazin-3-one IUPAC Name: 6-[[[1-[2-hydroxy-2-(6-methoxyquinolin-4-yl)ethyl]piperidin-2-yl]methylamino]methyl]-4H-1,4-benzoxazin-3-one Traditional Name: 6-[[[1-[2-hydroxy-2-(6-methoxy-4-quinolyl)ethyl]-2-piperidyl]methylamino]methyl]-4H-1,4-benzoxazin-3-one Formula: C27H32N4O4 MolecularWeight: 476.56738

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=CN=C2C=C1)C(CN3CCCCC3CNCC4=CC5=C(C=C4)OCC(=O)N5)O

Isomeric SMILES

COC1=CC2=C(C=CN=C2C=C1)C(CN3CCCCC3CNCC4=CC5=C(C=C4)OCC(=O)N5)O

InChI

InChI=1S/C27H32N4O4/c1-34-20-6-7-23-22(13-20)21(9-10-29-23)25(32)16-31-11-3-2-4-19(31)15-28-14-18-5-8-26-24(12-18)30-27(33)17-35-26/h5-10,12-13,19,25,28,32H,2-4,11,14-17H2,1H3,(H,30,33)