4-[(2R)-3-(4-butylpiperidin-1-yl)-2-oxidanyl-propyl]-6-methyl-1,4-benzoxazin-3-one

Systemtic Name: 4-[(2R)-3-(4-butylpiperidin-1-yl)-2-oxidanyl-propyl]-6-methyl-1,4-benzoxazin-3-one Openeye Name: 4-[(2R)-3-(4-butyl-1-piperidyl)-2-hydroxy-propyl]-6-methyl-1,4-benzoxazin-3-one CAS Name: 4-[(2R)-3-(4-butyl-1-piperidinyl)-2-hydroxypropyl]-6-methyl-1,4-benzoxazin-3-one IUPAC Name: 4-[(2R)-3-(4-butylpiperidin-1-yl)-2-hydroxypropyl]-6-methyl-1,4-benzoxazin-3-one Traditional Name: 4-[(2R)-3-(4-butylpiperidino)-2-hydroxy-propyl]-6-methyl-1,4-benzoxazin-3-one Formula: C21H32N2O3 MolecularWeight: 360.49038

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CCN(CC1)CC(CN2C(=O)COC3=C2C=C(C=C3)C)O

Isomeric SMILES

CCCCC1CCN(CC1)C[C@H](CN2C(=O)COC3=C2C=C(C=C3)C)O

InChI

InChI=1S/C21H32N2O3/c1-3-4-5-17-8-10-22(11-9-17)13-18(24)14-23-19-12-16(2)6-7-20(19)26-15-21(23)25/h6-7,12,17-18,24H,3-5,8-11,13-15H2,1-2H3/t18-/m1/s1