tert-butyl (3S)-3-(2-azidoethyl)-3-indol-1-yl-2-oxidanyl-2H-indole-1-carboxylate

Systemtic Name: tert-butyl (3S)-3-(2-azidoethyl)-3-indol-1-yl-2-oxidanyl-2H-indole-1-carboxylate Openeye Name: tert-butyl (3S)-3-(2-azidoethyl)-2-hydroxy-3-indol-1-yl-indoline-1-carboxylate CAS Name: (3S)-3-(2-azidoethyl)-2-hydroxy-3-(1-indolyl)-2H-indole-1-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl (3S)-3-(2-azidoethyl)-2-hydroxy-3-indol-1-yl-2H-indole-1-carboxylate Traditional Name: (3S)-3-(2-azidoethyl)-2-hydroxy-3-indol-1-yl-indoline-1-carboxylic acid tert-butyl ester Formula: C23H25N5O3 MolecularWeight: 419.4763

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C(C(C2=CC=CC=C21)(CCN=[N+]=[N-])N3C=CC4=CC=CC=C43)O

Isomeric SMILES

CC(C)(C)OC(=O)N1C([C@@](C2=CC=CC=C21)(CCN=[N+]=[N-])N3C=CC4=CC=CC=C43)O

InChI

InChI=1S/C23H25N5O3/c1-22(2,3)31-21(30)28-19-11-7-5-9-17(19)23(20(28)29,13-14-25-26-24)27-15-12-16-8-4-6-10-18(16)27/h4-12,15,20,29H,13-14H2,1-3H3/t20?,23-/m0/s1