[2-oxidanylidene-2-[[2-[[(1R)-1-phenylethyl]carbamoyl]phenyl]amino]ethyl] 1-oxidanidylpyridin-1-ium-2-carboxylate

Systemtic Name: [2-oxidanylidene-2-[[2-[[(1R)-1-phenylethyl]carbamoyl]phenyl]amino]ethyl] 1-oxidanidylpyridin-1-ium-2-carboxylate Openeye Name: [2-oxo-2-[2-[[(1R)-1-phenylethyl]carbamoyl]anilino]ethyl] 1-oxidopyridin-1-ium-2-carboxylate CAS Name: 1-oxido-2-pyridin-1-iumcarboxylic acid [2-oxo-2-[2-[oxo-[[(1R)-1-phenylethyl]amino]methyl]anilino]ethyl] ester IUPAC Name: [2-oxo-2-[2-[[(1R)-1-phenylethyl]carbamoyl]anilino]ethyl] 1-oxidopyridin-1-ium-2-carboxylate Traditional Name: 1-oxidopyridin-1-ium-2-carboxylic acid [2-keto-2-[2-[[(1R)-1-phenylethyl]carbamoyl]anilino]ethyl] ester Formula: C23H21N3O5 MolecularWeight: 419.42994

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)C2=CC=CC=C2NC(=O)COC(=O)C3=CC=CC=[N+]3[O-]

Isomeric SMILES

C[C@H](C1=CC=CC=C1)NC(=O)C2=CC=CC=C2NC(=O)COC(=O)C3=CC=CC=[N+]3[O-]

InChI

InChI=1S/C23H21N3O5/c1-16(17-9-3-2-4-10-17)24-22(28)18-11-5-6-12-19(18)25-21(27)15-31-23(29)20-13-7-8-14-26(20)30/h2-14,16H,15H2,1H3,(H,24,28)(H,25,27)/t16-/m1/s1