diethyl (2S)-2-[[4-(3-methanoylpyrrol-1-yl)phenyl]carbonylamino]pentanedioate

Systemtic Name: diethyl (2S)-2-[[4-(3-methanoylpyrrol-1-yl)phenyl]carbonylamino]pentanedioate Openeye Name: diethyl (2S)-2-[[4-(3-formylpyrrol-1-yl)benzoyl]amino]pentanedioate CAS Name: (2S)-2-[[[4-(3-formyl-1-pyrrolyl)phenyl]-oxomethyl]amino]pentanedioic acid diethyl ester IUPAC Name: diethyl (2S)-2-[[4-(3-formylpyrrol-1-yl)benzoyl]amino]pentanedioate Traditional Name: (2S)-2-[[4-(3-formylpyrrol-1-yl)benzoyl]amino]glutaric acid diethyl ester Formula: C21H24N2O6 MolecularWeight: 400.42506

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(C(=O)OCC)NC(=O)C1=CC=C(C=C1)N2C=CC(=C2)C=O

Isomeric SMILES

CCOC(=O)CC[C@@H](C(=O)OCC)NC(=O)C1=CC=C(C=C1)N2C=CC(=C2)C=O

InChI

InChI=1S/C21H24N2O6/c1-3-28-19(25)10-9-18(21(27)29-4-2)22-20(26)16-5-7-17(8-6-16)23-12-11-15(13-23)14-24/h5-8,11-14,18H,3-4,9-10H2,1-2H3,(H,22,26)/t18-/m0/s1