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

Systemtic Name: 4-[2-[(4-methoxy-4-oxidanylidene-butan-2-yl)amino]-1-oxidanyl-ethyl]-7-oxidanyl-1H-indole-2-carboxylic acid Openeye Name: 7-hydroxy-4-[1-hydroxy-2-[(3-methoxy-1-methyl-3-oxo-propyl)amino]ethyl]-1H-indole-2-carboxylic acid CAS Name: 7-hydroxy-4-[1-hydroxy-2-[(4-methoxy-4-oxobutan-2-yl)amino]ethyl]-1H-indole-2-carboxylic acid IUPAC Name: 7-hydroxy-4-[1-hydroxy-2-[(4-methoxy-4-oxobutan-2-yl)amino]ethyl]-1H-indole-2-carboxylic acid Traditional Name: 7-hydroxy-4-[1-hydroxy-2-[(3-keto-3-methoxy-1-methyl-propyl)amino]ethyl]-1H-indole-2-carboxylic acid Formula: C16H20N2O6 MolecularWeight: 336.3398

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)OC)NCC(C1=C2C=C(NC2=C(C=C1)O)C(=O)O)O

Isomeric SMILES

CC(CC(=O)OC)NCC(C1=C2C=C(NC2=C(C=C1)O)C(=O)O)O

InChI

InChI=1S/C16H20N2O6/c1-8(5-14(21)24-2)17-7-13(20)9-3-4-12(19)15-10(9)6-11(18-15)16(22)23/h3-4,6,8,13,17-20H,5,7H2,1-2H3,(H,22,23)