4-[2-(tert-butylamino)-1-oxidanyl-propyl]-7-oxidanyl-1H-indole-2-carboxylic acid

Systemtic Name: 4-[2-(tert-butylamino)-1-oxidanyl-propyl]-7-oxidanyl-1H-indole-2-carboxylic acid Openeye Name: 4-[2-(tert-butylamino)-1-hydroxy-propyl]-7-hydroxy-1H-indole-2-carboxylic acid CAS Name: 4-[2-(tert-butylamino)-1-hydroxypropyl]-7-hydroxy-1H-indole-2-carboxylic acid IUPAC Name: 4-[2-(tert-butylamino)-1-hydroxypropyl]-7-hydroxy-1H-indole-2-carboxylic acid Traditional Name: 4-[2-(tert-butylamino)-1-hydroxy-propyl]-7-hydroxy-1H-indole-2-carboxylic acid Formula: C16H22N2O4 MolecularWeight: 306.35688

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C1=C2C=C(NC2=C(C=C1)O)C(=O)O)O)NC(C)(C)C

Isomeric SMILES

CC(C(C1=C2C=C(NC2=C(C=C1)O)C(=O)O)O)NC(C)(C)C

InChI

InChI=1S/C16H22N2O4/c1-8(18-16(2,3)4)14(20)9-5-6-12(19)13-10(9)7-11(17-13)15(21)22/h5-8,14,17-20H,1-4H3,(H,21,22)