diethyl 5-[[4-[1-(cyclopropylamino)-1-oxidanylidene-propan-2-yl]piperazin-1-yl]methyl]-3-methyl-1H-pyrrole-2,4-dicarboxylate

Systemtic Name: diethyl 5-[[4-[1-(cyclopropylamino)-1-oxidanylidene-propan-2-yl]piperazin-1-yl]methyl]-3-methyl-1H-pyrrole-2,4-dicarboxylate Openeye Name: diethyl 5-[[4-[2-(cyclopropylamino)-1-methyl-2-oxo-ethyl]piperazin-1-yl]methyl]-3-methyl-1H-pyrrole-2,4-dicarboxylate CAS Name: 5-[[4-[1-(cyclopropylamino)-1-oxopropan-2-yl]-1-piperazinyl]methyl]-3-methyl-1H-pyrrole-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-[[4-[1-(cyclopropylamino)-1-oxopropan-2-yl]piperazin-1-yl]methyl]-3-methyl-1H-pyrrole-2,4-dicarboxylate Traditional Name: 5-[[4-[2-(cyclopropylamino)-2-keto-1-methyl-ethyl]piperazino]methyl]-3-methyl-1H-pyrrole-2,4-dicarboxylic acid diethyl ester Formula: C22H34N4O5 MolecularWeight: 434.52916

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C)C(=O)OCC)CN2CCN(CC2)C(C)C(=O)NC3CC3

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C)C(=O)OCC)CN2CCN(CC2)C(C)C(=O)NC3CC3

InChI

InChI=1S/C22H34N4O5/c1-5-30-21(28)18-14(3)19(22(29)31-6-2)24-17(18)13-25-9-11-26(12-10-25)15(4)20(27)23-16-7-8-16/h15-16,24H,5-13H2,1-4H3,(H,23,27)