[1-azido-1-methyl-2,3-bis(phenylmethoxy)-3-(phenylmethoxymethyl)pyrrolidin-1-ium-2-yl]methanol

Systemtic Name: [1-azido-1-methyl-2,3-bis(phenylmethoxy)-3-(phenylmethoxymethyl)pyrrolidin-1-ium-2-yl]methanol Openeye Name: [1-azido-2,3-dibenzyloxy-3-(benzyloxymethyl)-1-methyl-pyrrolidin-1-ium-2-yl]methanol CAS Name: [1-azido-1-methyl-2,3-bis(phenylmethoxy)-3-(phenylmethoxymethyl)-2-pyrrolidin-1-iumyl]methanol IUPAC Name: [1-azido-1-methyl-2,3-bis(phenylmethoxy)-3-(phenylmethoxymethyl)pyrrolidin-1-ium-2-yl]methanol Traditional Name: [1-azido-2,3-dibenzoxy-3-(benzoxymethyl)-1-methyl-pyrrolidin-1-ium-2-yl]methanol Formula: C28H33N4O4+ MolecularWeight: 489.58602

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCC(C1(CO)OCC2=CC=CC=C2)(COCC3=CC=CC=C3)OCC4=CC=CC=C4)N=[N+]=[N-]

Isomeric SMILES

C[N+]1(CCC(C1(CO)OCC2=CC=CC=C2)(COCC3=CC=CC=C3)OCC4=CC=CC=C4)N=[N+]=[N-]

InChI

InChI=1S/C28H33N4O4/c1-32(31-30-29)18-17-27(35-20-25-13-7-3-8-14-25,23-34-19-24-11-5-2-6-12-24)28(32,22-33)36-21-26-15-9-4-10-16-26/h2-16,33H,17-23H2,1H3/q+1