6-[1-(methylamino)-2-[4-(2-methylquinolin-5-yl)piperazin-1-yl]ethyl]-4H-1,4-benzoxazin-3-one

Systemtic Name: 6-[1-(methylamino)-2-[4-(2-methylquinolin-5-yl)piperazin-1-yl]ethyl]-4H-1,4-benzoxazin-3-one Openeye Name: 6-[1-(methylamino)-2-[4-(2-methyl-5-quinolyl)piperazin-1-yl]ethyl]-4H-1,4-benzoxazin-3-one CAS Name: 6-[1-(methylamino)-2-[4-(2-methyl-5-quinolinyl)-1-piperazinyl]ethyl]-4H-1,4-benzoxazin-3-one IUPAC Name: 6-[1-(methylamino)-2-[4-(2-methylquinolin-5-yl)piperazin-1-yl]ethyl]-4H-1,4-benzoxazin-3-one Traditional Name: 6-[1-(methylamino)-2-[4-(2-methyl-5-quinolyl)piperazino]ethyl]-4H-1,4-benzoxazin-3-one Formula: C25H29N5O2 MolecularWeight: 431.53006

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C1)C(=CC=C2)N3CCN(CC3)CC(C4=CC5=C(C=C4)OCC(=O)N5)NC

Isomeric SMILES

CC1=NC2=C(C=C1)C(=CC=C2)N3CCN(CC3)CC(C4=CC5=C(C=C4)OCC(=O)N5)NC

InChI

InChI=1S/C25H29N5O2/c1-17-6-8-19-20(27-17)4-3-5-23(19)30-12-10-29(11-13-30)15-22(26-2)18-7-9-24-21(14-18)28-25(31)16-32-24/h3-9,14,22,26H,10-13,15-16H2,1-2H3,(H,28,31)