4-[[3-[1-(4-ethylpiperazin-1-yl)-2-oxidanyl-2-oxidanylidene-ethyl]-1H-indol-6-yl]amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[[3-[1-(4-ethylpiperazin-1-yl)-2-oxidanyl-2-oxidanylidene-ethyl]-1H-indol-6-yl]amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[[3-[1-(4-ethylpiperazin-1-yl)-2-hydroxy-2-oxo-ethyl]-1H-indol-6-yl]amino]-4-oxo-butanoic acid CAS Name: 4-[[3-[1-(4-ethyl-1-piperazinyl)-2-hydroxy-2-oxoethyl]-1H-indol-6-yl]amino]-4-oxobutanoic acid IUPAC Name: 4-[[3-[1-(4-ethylpiperazin-1-yl)-2-hydroxy-2-oxoethyl]-1H-indol-6-yl]amino]-4-oxobutanoic acid Traditional Name: 4-[[3-[1-(4-ethylpiperazino)-2-hydroxy-2-keto-ethyl]-1H-indol-6-yl]amino]-4-keto-butyric acid Formula: C20H26N4O5 MolecularWeight: 402.44424

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C(C2=CNC3=C2C=CC(=C3)NC(=O)CCC(=O)O)C(=O)O

Isomeric SMILES

CCN1CCN(CC1)C(C2=CNC3=C2C=CC(=C3)NC(=O)CCC(=O)O)C(=O)O

InChI

InChI=1S/C20H26N4O5/c1-2-23-7-9-24(10-8-23)19(20(28)29)15-12-21-16-11-13(3-4-14(15)16)22-17(25)5-6-18(26)27/h3-4,11-12,19,21H,2,5-10H2,1H3,(H,22,25)(H,26,27)(H,28,29)