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

Systemtic Name: O2-ethyl O4-[2-oxidanylidene-2-[[(1R)-1-phenylbutyl]amino]ethyl] 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Openeye Name: O2-ethyl O4-[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 O2-ethyl ester O4-[2-oxo-2-[[(1R)-1-phenylbutyl]amino]ethyl] ester IUPAC Name: 2-O-ethyl 4-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-ethyl ester O4-[2-keto-2-[[(1R)-1-phenylbutyl]amino]ethyl] ester Formula: C22H28N2O5 MolecularWeight: 400.46812

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=CC=CC=C1)NC(=O)COC(=O)C2=C(NC(=C2C)C(=O)OCC)C

Isomeric SMILES

CCC[C@H](C1=CC=CC=C1)NC(=O)COC(=O)C2=C(NC(=C2C)C(=O)OCC)C

InChI

InChI=1S/C22H28N2O5/c1-5-10-17(16-11-8-7-9-12-16)24-18(25)13-29-21(26)19-14(3)20(23-15(19)4)22(27)28-6-2/h7-9,11-12,17,23H,5-6,10,13H2,1-4H3,(H,24,25)/t17-/m1/s1