1-[1-[2-methoxy-4-[(1-oxidanidyl-2-propan-2-yl-pyridin-1-ium-3-yl)methoxy]phenyl]carbonylpiperidin-4-yl]-4H-3,1-benzoxazin-2-one

Systemtic Name: 1-[1-[2-methoxy-4-[(1-oxidanidyl-2-propan-2-yl-pyridin-1-ium-3-yl)methoxy]phenyl]carbonylpiperidin-4-yl]-4H-3,1-benzoxazin-2-one Openeye Name: 1-[1-[4-[(2-isopropyl-1-oxido-pyridin-1-ium-3-yl)methoxy]-2-methoxy-benzoyl]-4-piperidyl]-4H-3,1-benzoxazin-2-one CAS Name: 1-[1-[[2-methoxy-4-[(1-oxido-2-propan-2-yl-3-pyridin-1-iumyl)methoxy]phenyl]-oxomethyl]-4-piperidinyl]-4H-3,1-benzoxazin-2-one IUPAC Name: 1-[1-[2-methoxy-4-[(1-oxido-2-propan-2-ylpyridin-1-ium-3-yl)methoxy]benzoyl]piperidin-4-yl]-4H-3,1-benzoxazin-2-one Traditional Name: 1-[1-[4-[(2-isopropyl-1-oxido-pyridin-1-ium-3-yl)methoxy]-2-methoxy-benzoyl]-4-piperidyl]-4H-3,1-benzoxazin-2-one Formula: C30H33N3O6 MolecularWeight: 531.59952

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C=CC=[N+]1[O-])COC2=CC(=C(C=C2)C(=O)N3CCC(CC3)N4C5=CC=CC=C5COC4=O)OC

Isomeric SMILES

CC(C)C1=C(C=CC=[N+]1[O-])COC2=CC(=C(C=C2)C(=O)N3CCC(CC3)N4C5=CC=CC=C5COC4=O)OC

InChI

InChI=1S/C30H33N3O6/c1-20(2)28-22(8-6-14-32(28)36)19-38-24-10-11-25(27(17-24)37-3)29(34)31-15-12-23(13-16-31)33-26-9-5-4-7-21(26)18-39-30(33)35/h4-11,14,17,20,23H,12-13,15-16,18-19H2,1-3H3