propan-2-yl 2,4-dimethyl-5-(3-oxidanylidenepiperazin-1-yl)carbonyl-1H-pyrrole-3-carboxylate

Systemtic Name: propan-2-yl 2,4-dimethyl-5-(3-oxidanylidenepiperazin-1-yl)carbonyl-1H-pyrrole-3-carboxylate Openeye Name: isopropyl 2,4-dimethyl-5-(3-oxopiperazine-1-carbonyl)-1H-pyrrole-3-carboxylate CAS Name: 2,4-dimethyl-5-[oxo-(3-oxo-1-piperazinyl)methyl]-1H-pyrrole-3-carboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 2,4-dimethyl-5-(3-oxopiperazine-1-carbonyl)-1H-pyrrole-3-carboxylate Traditional Name: 5-(3-ketopiperazine-1-carbonyl)-2,4-dimethyl-1H-pyrrole-3-carboxylic acid isopropyl ester Formula: C15H21N3O4 MolecularWeight: 307.34494

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H21N3O4/c1-8(2)22-15(21)12-9(3)13(17-10(12)4)14(20)18-6-5-16-11(19)7-18/h8,17H,5-7H2,1-4H3,(H,16,19)