1-methyl-3-[2-oxidanyl-2-oxidanylidene-1-[4-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)piperazin-1-yl]ethyl]indole-2-carboxylic acid

Systemtic Name: 1-methyl-3-[2-oxidanyl-2-oxidanylidene-1-[4-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)piperazin-1-yl]ethyl]indole-2-carboxylic acid Openeye Name: 3-[2-hydroxy-2-oxo-1-[4-(2-oxo-2-pyrrolidin-1-yl-ethyl)piperazin-1-yl]ethyl]-1-methyl-indole-2-carboxylic acid CAS Name: 3-[2-hydroxy-2-oxo-1-[4-[2-oxo-2-(1-pyrrolidinyl)ethyl]-1-piperazinyl]ethyl]-1-methyl-2-indolecarboxylic acid IUPAC Name: 3-[2-hydroxy-2-oxo-1-[4-(2-oxo-2-pyrrolidin-1-ylethyl)piperazin-1-yl]ethyl]-1-methylindole-2-carboxylic acid Traditional Name: 3-[2-hydroxy-2-keto-1-[4-(2-keto-2-pyrrolidino-ethyl)piperazino]ethyl]-1-methyl-indole-2-carboxylic acid Formula: C22H28N4O5 MolecularWeight: 428.48152

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(=C1C(=O)O)C(C(=O)O)N3CCN(CC3)CC(=O)N4CCCC4

Isomeric SMILES

CN1C2=CC=CC=C2C(=C1C(=O)O)C(C(=O)O)N3CCN(CC3)CC(=O)N4CCCC4

InChI

InChI=1S/C22H28N4O5/c1-23-16-7-3-2-6-15(16)18(19(23)21(28)29)20(22(30)31)26-12-10-24(11-13-26)14-17(27)25-8-4-5-9-25/h2-3,6-7,20H,4-5,8-14H2,1H3,(H,28,29)(H,30,31)