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

Systemtic Name: O4-methyl O2-[2-oxidanylidene-2-[[(1R)-1-phenylbutyl]amino]ethyl] 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Openeye Name: O4-methyl O2-[2-oxo-2-[[(1R)-1-phenylbutyl]amino]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-[[(1R)-1-phenylbutyl]amino]ethyl] ester IUPAC Name: 4-O-methyl 2-O-[2-oxo-2-[[(1R)-1-phenylbutyl]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-phenylbutyl]amino]ethyl] ester O4-methyl ester Formula: C21H26N2O5 MolecularWeight: 386.44154

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=CC=CC=C1)NC(=O)COC(=O)C2=C(C(=C(N2)C)C(=O)OC)C

Isomeric SMILES

CCC[C@H](C1=CC=CC=C1)NC(=O)COC(=O)C2=C(C(=C(N2)C)C(=O)OC)C

InChI

InChI=1S/C21H26N2O5/c1-5-9-16(15-10-7-6-8-11-15)23-17(24)12-28-21(26)19-13(2)18(14(3)22-19)20(25)27-4/h6-8,10-11,16,22H,5,9,12H2,1-4H3,(H,23,24)/t16-/m1/s1