O4-methyl O2-[2-oxidanylidene-2-[[(2R)-4-phenylbutan-2-yl]amino]ethyl] 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate

Systemtic Name: O4-methyl O2-[2-oxidanylidene-2-[[(2R)-4-phenylbutan-2-yl]amino]ethyl] 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Openeye Name: O4-methyl O2-[2-[[(1R)-1-methyl-3-phenyl-propyl]amino]-2-oxo-ethyl] 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate CAS Name: 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylic acid O4-methyl ester O2-[2-oxo-2-[[(2R)-4-phenylbutan-2-yl]amino]ethyl] ester IUPAC Name: 4-O-methyl 2-O-[2-oxo-2-[[(2R)-4-phenylbutan-2-yl]amino]ethyl] 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Traditional Name: 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylic acid O2-[2-keto-2-[[(1R)-1-methyl-3-phenyl-propyl]amino]ethyl] ester O4-methyl ester Formula: C21H26N2O5 MolecularWeight: 386.44154

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)OC)C)C(=O)OCC(=O)NC(C)CCC2=CC=CC=C2

Isomeric SMILES

CC1=C(NC(=C1C(=O)OC)C)C(=O)OCC(=O)N[C@H](C)CCC2=CC=CC=C2

InChI

InChI=1S/C21H26N2O5/c1-13(10-11-16-8-6-5-7-9-16)22-17(24)12-28-21(26)19-14(2)18(15(3)23-19)20(25)27-4/h5-9,13,23H,10-12H2,1-4H3,(H,22,24)/t13-/m1/s1