2-methyl-1-oxidanidyl-3-phenylmethoxy-4,5-bis(phenylmethoxymethyl)pyridin-1-ium

Systemtic Name: 2-methyl-1-oxidanidyl-3-phenylmethoxy-4,5-bis(phenylmethoxymethyl)pyridin-1-ium Openeye Name: 3-benzyloxy-4,5-bis(benzyloxymethyl)-2-methyl-1-oxido-pyridin-1-ium CAS Name: 2-methyl-1-oxido-3-phenylmethoxy-4,5-bis(phenylmethoxymethyl)pyridin-1-ium IUPAC Name: 2-methyl-1-oxido-3-phenylmethoxy-4,5-bis(phenylmethoxymethyl)pyridin-1-ium Traditional Name: 3-benzoxy-4,5-bis(benzoxymethyl)-2-methyl-1-oxido-pyridin-1-ium Formula: C29H29NO4 MolecularWeight: 455.54486

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C=C(C(=C1OCC2=CC=CC=C2)COCC3=CC=CC=C3)COCC4=CC=CC=C4)[O-]

Isomeric SMILES

CC1=[N+](C=C(C(=C1OCC2=CC=CC=C2)COCC3=CC=CC=C3)COCC4=CC=CC=C4)[O-]

InChI

InChI=1S/C29H29NO4/c1-23-29(34-20-26-15-9-4-10-16-26)28(22-33-19-25-13-7-3-8-14-25)27(17-30(23)31)21-32-18-24-11-5-2-6-12-24/h2-17H,18-22H2,1H3