4-[2-[[4-(2-morpholin-4-ylethoxy)-4-oxidanylidene-butan-2-yl]amino]-1-oxidanyl-ethyl]-7-oxidanyl-1H-indole-2-carboxylic acid

Systemtic Name: 4-[2-[[4-(2-morpholin-4-ylethoxy)-4-oxidanylidene-butan-2-yl]amino]-1-oxidanyl-ethyl]-7-oxidanyl-1H-indole-2-carboxylic acid Openeye Name: 7-hydroxy-4-[1-hydroxy-2-[[1-methyl-3-(2-morpholinoethoxy)-3-oxo-propyl]amino]ethyl]-1H-indole-2-carboxylic acid CAS Name: 7-hydroxy-4-[1-hydroxy-2-[[4-[2-(4-morpholinyl)ethoxy]-4-oxobutan-2-yl]amino]ethyl]-1H-indole-2-carboxylic acid IUPAC Name: 7-hydroxy-4-[1-hydroxy-2-[[4-(2-morpholin-4-ylethoxy)-4-oxobutan-2-yl]amino]ethyl]-1H-indole-2-carboxylic acid Traditional Name: 7-hydroxy-4-[1-hydroxy-2-[[3-keto-1-methyl-3-(2-morpholinoethoxy)propyl]amino]ethyl]-1H-indole-2-carboxylic acid Formula: C21H29N3O7 MolecularWeight: 435.47086

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)OCCN1CCOCC1)NCC(C2=C3C=C(NC3=C(C=C2)O)C(=O)O)O

Isomeric SMILES

CC(CC(=O)OCCN1CCOCC1)NCC(C2=C3C=C(NC3=C(C=C2)O)C(=O)O)O

InChI

InChI=1S/C21H29N3O7/c1-13(10-19(27)31-9-6-24-4-7-30-8-5-24)22-12-18(26)14-2-3-17(25)20-15(14)11-16(23-20)21(28)29/h2-3,11,13,18,22-23,25-26H,4-10,12H2,1H3,(H,28,29)