methyl 2-[[4-[2-(4-ethanoylpiperazin-1-yl)-2-oxidanylidene-ethanoyl]-1H-pyrrol-2-yl]methylamino]ethanoate

Systemtic Name: methyl 2-[[4-[2-(4-ethanoylpiperazin-1-yl)-2-oxidanylidene-ethanoyl]-1H-pyrrol-2-yl]methylamino]ethanoate Openeye Name: methyl 2-[[4-[2-(4-acetylpiperazin-1-yl)-2-oxo-acetyl]-1H-pyrrol-2-yl]methylamino]acetate CAS Name: 2-[[4-[2-(4-acetyl-1-piperazinyl)-1,2-dioxoethyl]-1H-pyrrol-2-yl]methylamino]acetic acid methyl ester IUPAC Name: methyl 2-[[4-[2-(4-acetylpiperazin-1-yl)-2-oxoacetyl]-1H-pyrrol-2-yl]methylamino]acetate Traditional Name: 2-[[4-[2-(4-acetylpiperazino)-2-keto-acetyl]-1H-pyrrol-2-yl]methylamino]acetic acid methyl ester Formula: C16H22N4O5 MolecularWeight: 350.36968

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C(=O)C(=O)C2=CNC(=C2)CNCC(=O)OC

Isomeric SMILES

CC(=O)N1CCN(CC1)C(=O)C(=O)C2=CNC(=C2)CNCC(=O)OC

InChI

InChI=1S/C16H22N4O5/c1-11(21)19-3-5-20(6-4-19)16(24)15(23)12-7-13(18-8-12)9-17-10-14(22)25-2/h7-8,17-18H,3-6,9-10H2,1-2H3