4-methyl-8-[3-[(2R)-2-methyl-4-(2-methylquinolin-5-yl)piperazin-1-yl]propyl]-1,4-benzoxazin-3-one

Systemtic Name: 4-methyl-8-[3-[(2R)-2-methyl-4-(2-methylquinolin-5-yl)piperazin-1-yl]propyl]-1,4-benzoxazin-3-one Openeye Name: 4-methyl-8-[3-[(2R)-2-methyl-4-(2-methyl-5-quinolyl)piperazin-1-yl]propyl]-1,4-benzoxazin-3-one CAS Name: 4-methyl-8-[3-[(2R)-2-methyl-4-(2-methyl-5-quinolinyl)-1-piperazinyl]propyl]-1,4-benzoxazin-3-one IUPAC Name: 4-methyl-8-[3-[(2R)-2-methyl-4-(2-methylquinolin-5-yl)piperazin-1-yl]propyl]-1,4-benzoxazin-3-one Traditional Name: 4-methyl-8-[3-[(2R)-2-methyl-4-(2-methyl-5-quinolyl)piperazino]propyl]-1,4-benzoxazin-3-one Formula: C27H32N4O2 MolecularWeight: 444.56858

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1CCCC2=C3C(=CC=C2)N(C(=O)CO3)C)C4=CC=CC5=C4C=CC(=N5)C

Isomeric SMILES

C[C@@H]1CN(CCN1CCCC2=C3C(=CC=C2)N(C(=O)CO3)C)C4=CC=CC5=C4C=CC(=N5)C

InChI

InChI=1S/C27H32N4O2/c1-19-12-13-22-23(28-19)9-5-10-24(22)31-16-15-30(20(2)17-31)14-6-8-21-7-4-11-25-27(21)33-18-26(32)29(25)3/h4-5,7,9-13,20H,6,8,14-18H2,1-3H3/t20-/m1/s1