4-[[3-[1-(4-methanoylpiperazin-1-yl)-2-oxidanyl-2-oxidanylidene-ethyl]-1H-indol-5-yl]amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[[3-[1-(4-methanoylpiperazin-1-yl)-2-oxidanyl-2-oxidanylidene-ethyl]-1H-indol-5-yl]amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[[3-[1-(4-formylpiperazin-1-yl)-2-hydroxy-2-oxo-ethyl]-1H-indol-5-yl]amino]-4-oxo-butanoic acid CAS Name: 4-[[3-[1-(4-formyl-1-piperazinyl)-2-hydroxy-2-oxoethyl]-1H-indol-5-yl]amino]-4-oxobutanoic acid IUPAC Name: 4-[[3-[1-(4-formylpiperazin-1-yl)-2-hydroxy-2-oxoethyl]-1H-indol-5-yl]amino]-4-oxobutanoic acid Traditional Name: 4-[[3-[1-(4-formylpiperazino)-2-hydroxy-2-keto-ethyl]-1H-indol-5-yl]amino]-4-keto-butyric acid Formula: C19H22N4O6 MolecularWeight: 402.40118

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C=O)C(C2=CNC3=C2C=C(C=C3)NC(=O)CCC(=O)O)C(=O)O

Isomeric SMILES

C1CN(CCN1C=O)C(C2=CNC3=C2C=C(C=C3)NC(=O)CCC(=O)O)C(=O)O

InChI

InChI=1S/C19H22N4O6/c24-11-22-5-7-23(8-6-22)18(19(28)29)14-10-20-15-2-1-12(9-13(14)15)21-16(25)3-4-17(26)27/h1-2,9-11,18,20H,3-8H2,(H,21,25)(H,26,27)(H,28,29)