N-[2-[3-(tert-butylamino)-2-oxidanyl-propoxy]phenyl]-1H-indole-4-carboxamide; ethanedioic acid

Systemtic Name: N-[2-[3-(tert-butylamino)-2-oxidanyl-propoxy]phenyl]-1H-indole-4-carboxamide; ethanedioic acid Openeye Name: N-[2-[3-(tert-butylamino)-2-hydroxy-propoxy]phenyl]-1H-indole-4-carboxamide; oxalic acid CAS Name: N-[2-[3-(tert-butylamino)-2-hydroxypropoxy]phenyl]-1H-indole-4-carboxamide; oxalic acid IUPAC Name: N-[2-[3-(tert-butylamino)-2-hydroxypropoxy]phenyl]-1H-indole-4-carboxamide; oxalic acid Traditional Name: N-[2-[3-(tert-butylamino)-2-hydroxy-propoxy]phenyl]-1H-indole-4-carboxamide; oxalic acid Formula: C24H29N3O7 MolecularWeight: 471.50296

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NCC(COC1=CC=CC=C1NC(=O)C2=C3C=CNC3=CC=C2)O.C(=O)(C(=O)O)O

Isomeric SMILES

CC(C)(C)NCC(COC1=CC=CC=C1NC(=O)C2=C3C=CNC3=CC=C2)O.C(=O)(C(=O)O)O

InChI

InChI=1S/C22H27N3O3.C2H2O4/c1-22(2,3)24-13-15(26)14-28-20-10-5-4-8-19(20)25-21(27)17-7-6-9-18-16(17)11-12-23-18;3-1(4)2(5)6/h4-12,15,23-24,26H,13-14H2,1-3H3,(H,25,27);(H,3,4)(H,5,6)