(phenylmethyl) N-[1-oxidanylidene-3-phenyl-1-[2-(2-pyridin-1-ium-1-ylethanoyl)pyrrolidin-1-yl]propan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[1-oxidanylidene-3-phenyl-1-[2-(2-pyridin-1-ium-1-ylethanoyl)pyrrolidin-1-yl]propan-2-yl]carbamate Openeye Name: benzyl N-[1-benzyl-2-oxo-2-[2-(2-pyridin-1-ium-1-ylacetyl)pyrrolidin-1-yl]ethyl]carbamate CAS Name: N-[1-oxo-1-[2-[1-oxo-2-(1-pyridin-1-iumyl)ethyl]-1-pyrrolidinyl]-3-phenylpropan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[1-oxo-3-phenyl-1-[2-(2-pyridin-1-ium-1-ylacetyl)pyrrolidin-1-yl]propan-2-yl]carbamate Traditional Name: N-[1-benzyl-2-keto-2-[2-(2-pyridin-1-ium-1-ylacetyl)pyrrolidino]ethyl]carbamic acid benzyl ester Formula: C28H30N3O4+ MolecularWeight: 472.5555

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C(CC2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3)C(=O)C[N+]4=CC=CC=C4

Isomeric SMILES

C1CC(N(C1)C(=O)C(CC2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3)C(=O)C[N+]4=CC=CC=C4

InChI

InChI=1S/C28H29N3O4/c32-26(20-30-16-8-3-9-17-30)25-15-10-18-31(25)27(33)24(19-22-11-4-1-5-12-22)29-28(34)35-21-23-13-6-2-7-14-23/h1-9,11-14,16-17,24-25H,10,15,18-21H2/p+1