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

Systemtic Name: 4-[[3-[1-(4-methylpiperazin-1-yl)-2-oxidanyl-2-oxidanylidene-ethyl]-1H-indol-6-yl]amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[[3-[2-hydroxy-1-(4-methylpiperazin-1-yl)-2-oxo-ethyl]-1H-indol-6-yl]amino]-4-oxo-butanoic acid CAS Name: 4-[[3-[2-hydroxy-1-(4-methyl-1-piperazinyl)-2-oxoethyl]-1H-indol-6-yl]amino]-4-oxobutanoic acid IUPAC Name: 4-[[3-[2-hydroxy-1-(4-methylpiperazin-1-yl)-2-oxoethyl]-1H-indol-6-yl]amino]-4-oxobutanoic acid Traditional Name: 4-[[3-[2-hydroxy-2-keto-1-(4-methylpiperazino)ethyl]-1H-indol-6-yl]amino]-4-keto-butyric acid Formula: C19H24N4O5 MolecularWeight: 388.41766

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(C2=CNC3=C2C=CC(=C3)NC(=O)CCC(=O)O)C(=O)O

Isomeric SMILES

CN1CCN(CC1)C(C2=CNC3=C2C=CC(=C3)NC(=O)CCC(=O)O)C(=O)O

InChI

InChI=1S/C19H24N4O5/c1-22-6-8-23(9-7-22)18(19(27)28)14-11-20-15-10-12(2-3-13(14)15)21-16(24)4-5-17(25)26/h2-3,10-11,18,20H,4-9H2,1H3,(H,21,24)(H,25,26)(H,27,28)