methyl 3-[4-(diphenylmethyl)oxy-5-[(4-methoxyphenyl)methoxy]-1-oxidanidyl-pyridin-1-ium-2-yl]-1,2-oxazole-5-carboxylate

Systemtic Name: methyl 3-[4-(diphenylmethyl)oxy-5-[(4-methoxyphenyl)methoxy]-1-oxidanidyl-pyridin-1-ium-2-yl]-1,2-oxazole-5-carboxylate Openeye Name: methyl 3-[4-benzhydryloxy-5-[(4-methoxyphenyl)methoxy]-1-oxido-pyridin-1-ium-2-yl]isoxazole-5-carboxylate CAS Name: 3-[4-(diphenylmethyl)oxy-5-[(4-methoxyphenyl)methoxy]-1-oxido-2-pyridin-1-iumyl]-5-isoxazolecarboxylic acid methyl ester IUPAC Name: methyl 3-[4-benzhydryloxy-5-[(4-methoxyphenyl)methoxy]-1-oxidopyridin-1-ium-2-yl]-1,2-oxazole-5-carboxylate Traditional Name: 3-(4-benzhydryloxy-1-oxido-5-p-anisyloxy-pyridin-1-ium-2-yl)isoxazole-5-carboxylic acid methyl ester Formula: C31H26N2O7 MolecularWeight: 538.54734

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)COC2=C[N+](=C(C=C2OC(C3=CC=CC=C3)C4=CC=CC=C4)C5=NOC(=C5)C(=O)OC)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)COC2=C[N+](=C(C=C2OC(C3=CC=CC=C3)C4=CC=CC=C4)C5=NOC(=C5)C(=O)OC)[O-]

InChI

InChI=1S/C31H26N2O7/c1-36-24-15-13-21(14-16-24)20-38-29-19-33(35)26(25-17-28(40-32-25)31(34)37-2)18-27(29)39-30(22-9-5-3-6-10-22)23-11-7-4-8-12-23/h3-19,30H,20H2,1-2H3