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

Systemtic Name: 6-[[4-[(2-methylquinolin-5-yl)oxymethyl]piperidin-1-yl]methyl]-4H-1,4-benzoxazin-3-one Openeye Name: 6-[[4-[(2-methyl-5-quinolyl)oxymethyl]-1-piperidyl]methyl]-4H-1,4-benzoxazin-3-one CAS Name: 6-[[4-[(2-methyl-5-quinolinyl)oxymethyl]-1-piperidinyl]methyl]-4H-1,4-benzoxazin-3-one IUPAC Name: 6-[[4-[(2-methylquinolin-5-yl)oxymethyl]piperidin-1-yl]methyl]-4H-1,4-benzoxazin-3-one Traditional Name: 6-[[4-[(2-methyl-5-quinolyl)oxymethyl]piperidino]methyl]-4H-1,4-benzoxazin-3-one Formula: C25H27N3O3 MolecularWeight: 417.50018

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C1)C(=CC=C2)OCC3CCN(CC3)CC4=CC5=C(C=C4)OCC(=O)N5

Isomeric SMILES

CC1=NC2=C(C=C1)C(=CC=C2)OCC3CCN(CC3)CC4=CC5=C(C=C4)OCC(=O)N5

InChI

InChI=1S/C25H27N3O3/c1-17-5-7-20-21(26-17)3-2-4-23(20)30-15-18-9-11-28(12-10-18)14-19-6-8-24-22(13-19)27-25(29)16-31-24/h2-8,13,18H,9-12,14-16H2,1H3,(H,27,29)