tert-butyl N-[(1S)-1-(5-bromanyl-1-ethanoyl-indol-3-yl)-2-oxidanyl-ethyl]carbamate

Systemtic Name: tert-butyl N-[(1S)-1-(5-bromanyl-1-ethanoyl-indol-3-yl)-2-oxidanyl-ethyl]carbamate Openeye Name: tert-butyl N-[(1S)-1-(1-acetyl-5-bromo-indol-3-yl)-2-hydroxy-ethyl]carbamate CAS Name: N-[(1S)-1-(1-acetyl-5-bromo-3-indolyl)-2-hydroxyethyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(1S)-1-(1-acetyl-5-bromoindol-3-yl)-2-hydroxyethyl]carbamate Traditional Name: N-[(1S)-1-(1-acetyl-5-bromo-indol-3-yl)-2-hydroxy-ethyl]carbamic acid tert-butyl ester Formula: C17H21BrN2O4 MolecularWeight: 397.26364

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C=C(C2=C1C=CC(=C2)Br)C(CO)NC(=O)OC(C)(C)C

Isomeric SMILES

CC(=O)N1C=C(C2=C1C=CC(=C2)Br)[C@@H](CO)NC(=O)OC(C)(C)C

InChI

InChI=1S/C17H21BrN2O4/c1-10(22)20-8-13(12-7-11(18)5-6-15(12)20)14(9-21)19-16(23)24-17(2,3)4/h5-8,14,21H,9H2,1-4H3,(H,19,23)/t14-/m1/s1