methyl 2,4-dimethyl-5-[(2S)-2-(3-oxidanylidenepiperazin-1-yl)propanoyl]-1H-pyrrole-3-carboxylate

Systemtic Name: methyl 2,4-dimethyl-5-[(2S)-2-(3-oxidanylidenepiperazin-1-yl)propanoyl]-1H-pyrrole-3-carboxylate Openeye Name: methyl 2,4-dimethyl-5-[(2S)-2-(3-oxopiperazin-1-yl)propanoyl]-1H-pyrrole-3-carboxylate CAS Name: 2,4-dimethyl-5-[(2S)-1-oxo-2-(3-oxo-1-piperazinyl)propyl]-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 2,4-dimethyl-5-[(2S)-2-(3-oxopiperazin-1-yl)propanoyl]-1H-pyrrole-3-carboxylate Traditional Name: 5-[(2S)-2-(3-ketopiperazino)propanoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid methyl ester Formula: C15H21N3O4 MolecularWeight: 307.34494

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)OC)C)C(=O)C(C)N2CCNC(=O)C2

Isomeric SMILES

CC1=C(NC(=C1C(=O)OC)C)C(=O)[C@H](C)N2CCNC(=O)C2

InChI

InChI=1S/C15H21N3O4/c1-8-12(15(21)22-4)9(2)17-13(8)14(20)10(3)18-6-5-16-11(19)7-18/h10,17H,5-7H2,1-4H3,(H,16,19)/t10-/m0/s1