[(1R,2S)-2-azido-2,3-dihydro-1H-inden-1-yl] 4-methylbenzenesulfonate

Systemtic Name: [(1R,2S)-2-azido-2,3-dihydro-1H-inden-1-yl] 4-methylbenzenesulfonate Openeye Name: [(1R,2S)-2-azidoindan-1-yl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [(1R,2S)-2-azido-2,3-dihydro-1H-inden-1-yl] ester IUPAC Name: [(1R,2S)-2-azido-2,3-dihydro-1H-inden-1-yl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [(1R,2S)-2-azidoindan-1-yl] ester Formula: C16H15N3O3S MolecularWeight: 329.3736

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2C(CC3=CC=CC=C23)N=[N+]=[N-]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O[C@H]2[C@H](CC3=CC=CC=C23)N=[N+]=[N-]

InChI

InChI=1S/C16H15N3O3S/c1-11-6-8-13(9-7-11)23(20,21)22-16-14-5-3-2-4-12(14)10-15(16)18-19-17/h2-9,15-16H,10H2,1H3/t15-,16+/m0/s1