(phenylmethyl) N-[[2-[2-[2-(1-oxidanidylpyridin-1-ium-2-yl)ethylcarbamoyl]phenyl]phenyl]methyl]carbamate

Systemtic Name: (phenylmethyl) N-[[2-[2-[2-(1-oxidanidylpyridin-1-ium-2-yl)ethylcarbamoyl]phenyl]phenyl]methyl]carbamate Openeye Name: benzyl N-[[2-[2-[2-(1-oxidopyridin-1-ium-2-yl)ethylcarbamoyl]phenyl]phenyl]methyl]carbamate CAS Name: N-[[2-[2-[[2-(1-oxido-2-pyridin-1-iumyl)ethylamino]-oxomethyl]phenyl]phenyl]methyl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[[2-[2-[2-(1-oxidopyridin-1-ium-2-yl)ethylcarbamoyl]phenyl]phenyl]methyl]carbamate Traditional Name: N-[2-[2-[2-(1-oxidopyridin-1-ium-2-yl)ethylcarbamoyl]phenyl]benzyl]carbamic acid benzyl ester Formula: C29H27N3O4 MolecularWeight: 481.54238

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NCC2=CC=CC=C2C3=CC=CC=C3C(=O)NCCC4=CC=CC=[N+]4[O-]

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NCC2=CC=CC=C2C3=CC=CC=C3C(=O)NCCC4=CC=CC=[N+]4[O-]

InChI

InChI=1S/C29H27N3O4/c33-28(30-18-17-24-13-8-9-19-32(24)35)27-16-7-6-15-26(27)25-14-5-4-12-23(25)20-31-29(34)36-21-22-10-2-1-3-11-22/h1-16,19H,17-18,20-21H2,(H,30,33)(H,31,34)