3-[1-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxidanyl-2-oxidanylidene-ethyl]-1-methyl-indole-5-carboxylic acid

Systemtic Name: 3-[1-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxidanyl-2-oxidanylidene-ethyl]-1-methyl-indole-5-carboxylic acid Openeye Name: 3-[2-hydroxy-1-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxo-ethyl]-1-methyl-indole-5-carboxylic acid CAS Name: 3-[2-hydroxy-1-[4-(2-methoxyphenyl)-1-piperazinyl]-2-oxoethyl]-1-methyl-5-indolecarboxylic acid IUPAC Name: 3-[2-hydroxy-1-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxoethyl]-1-methylindole-5-carboxylic acid Traditional Name: 3-[2-hydroxy-2-keto-1-[4-(2-methoxyphenyl)piperazino]ethyl]-1-methyl-indole-5-carboxylic acid Formula: C23H25N3O5 MolecularWeight: 423.4617

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=C1C=CC(=C2)C(=O)O)C(C(=O)O)N3CCN(CC3)C4=CC=CC=C4OC

Isomeric SMILES

CN1C=C(C2=C1C=CC(=C2)C(=O)O)C(C(=O)O)N3CCN(CC3)C4=CC=CC=C4OC

InChI

InChI=1S/C23H25N3O5/c1-24-14-17(16-13-15(22(27)28)7-8-18(16)24)21(23(29)30)26-11-9-25(10-12-26)19-5-3-4-6-20(19)31-2/h3-8,13-14,21H,9-12H2,1-2H3,(H,27,28)(H,29,30)