tert-butyl 2-(1-azanyloxyethyl)-2-methyl-5-(quinolin-2-ylmethoxy)-3H-indole-1-carboxylate

Systemtic Name: tert-butyl 2-(1-azanyloxyethyl)-2-methyl-5-(quinolin-2-ylmethoxy)-3H-indole-1-carboxylate Openeye Name: tert-butyl 2-(1-aminooxyethyl)-2-methyl-5-(2-quinolylmethoxy)indoline-1-carboxylate CAS Name: 2-(1-aminooxyethyl)-2-methyl-5-(2-quinolinylmethoxy)-3H-indole-1-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-(1-aminooxyethyl)-2-methyl-5-(quinolin-2-ylmethoxy)-3H-indole-1-carboxylate Traditional Name: 2-(1-aminooxyethyl)-2-methyl-5-(2-quinolylmethoxy)indoline-1-carboxylic acid tert-butyl ester Formula: C26H31N3O4 MolecularWeight: 449.54204

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1(CC2=C(N1C(=O)OC(C)(C)C)C=CC(=C2)OCC3=NC4=CC=CC=C4C=C3)C)ON

Isomeric SMILES

CC(C1(CC2=C(N1C(=O)OC(C)(C)C)C=CC(=C2)OCC3=NC4=CC=CC=C4C=C3)C)ON

InChI

InChI=1S/C26H31N3O4/c1-17(33-27)26(5)15-19-14-21(12-13-23(19)29(26)24(30)32-25(2,3)4)31-16-20-11-10-18-8-6-7-9-22(18)28-20/h6-14,17H,15-16,27H2,1-5H3