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

Systemtic Name: 1-[1-[4-[(2-ethyl-1-oxidanidyl-pyridin-1-ium-3-yl)methoxy]-2-methoxy-phenyl]carbonylpiperidin-4-yl]-4H-3,1-benzoxazin-2-one Openeye Name: 1-[1-[4-[(2-ethyl-1-oxido-pyridin-1-ium-3-yl)methoxy]-2-methoxy-benzoyl]-4-piperidyl]-4H-3,1-benzoxazin-2-one CAS Name: 1-[1-[[4-[(2-ethyl-1-oxido-3-pyridin-1-iumyl)methoxy]-2-methoxyphenyl]-oxomethyl]-4-piperidinyl]-4H-3,1-benzoxazin-2-one IUPAC Name: 1-[1-[4-[(2-ethyl-1-oxidopyridin-1-ium-3-yl)methoxy]-2-methoxybenzoyl]piperidin-4-yl]-4H-3,1-benzoxazin-2-one Traditional Name: 1-[1-[4-[(2-ethyl-1-oxido-pyridin-1-ium-3-yl)methoxy]-2-methoxy-benzoyl]-4-piperidyl]-4H-3,1-benzoxazin-2-one Formula: C29H31N3O6 MolecularWeight: 517.57294

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC=[N+]1[O-])COC2=CC(=C(C=C2)C(=O)N3CCC(CC3)N4C5=CC=CC=C5COC4=O)OC

Isomeric SMILES

CCC1=C(C=CC=[N+]1[O-])COC2=CC(=C(C=C2)C(=O)N3CCC(CC3)N4C5=CC=CC=C5COC4=O)OC

InChI

InChI=1S/C29H31N3O6/c1-3-25-20(8-6-14-31(25)35)18-37-23-10-11-24(27(17-23)36-2)28(33)30-15-12-22(13-16-30)32-26-9-5-4-7-21(26)19-38-29(32)34/h4-11,14,17,22H,3,12-13,15-16,18-19H2,1-2H3