tert-butyl 6-bromanyl-2-methyl-3-[2-[methyl(oxidanyl)amino]-2-oxidanylidene-ethyl]indole-1-carboxylate

Systemtic Name: tert-butyl 6-bromanyl-2-methyl-3-[2-[methyl(oxidanyl)amino]-2-oxidanylidene-ethyl]indole-1-carboxylate Openeye Name: tert-butyl 6-bromo-3-[2-[hydroxy(methyl)amino]-2-oxo-ethyl]-2-methyl-indole-1-carboxylate CAS Name: 6-bromo-3-[2-[hydroxy(methyl)amino]-2-oxoethyl]-2-methyl-1-indolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 6-bromo-3-[2-[hydroxy(methyl)amino]-2-oxoethyl]-2-methylindole-1-carboxylate Traditional Name: 6-bromo-3-[2-[hydroxy(methyl)amino]-2-keto-ethyl]-2-methyl-indole-1-carboxylic acid tert-butyl ester Formula: C17H21BrN2O4 MolecularWeight: 397.26364

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1C(=O)OC(C)(C)C)C=C(C=C2)Br)CC(=O)N(C)O

Isomeric SMILES

CC1=C(C2=C(N1C(=O)OC(C)(C)C)C=C(C=C2)Br)CC(=O)N(C)O

InChI

InChI=1S/C17H21BrN2O4/c1-10-13(9-15(21)19(5)23)12-7-6-11(18)8-14(12)20(10)16(22)24-17(2,3)4/h6-8,23H,9H2,1-5H3