(2S)-2-azido-2-[(1S,4R)-4-(phenylsulfonyl)cyclopent-2-en-1-yl]ethanoic acid

Systemtic Name: (2S)-2-azido-2-[(1S,4R)-4-(phenylsulfonyl)cyclopent-2-en-1-yl]ethanoic acid Openeye Name: (2S)-2-azido-2-[(1S,4R)-4-(benzenesulfonyl)cyclopent-2-en-1-yl]acetic acid CAS Name: (2S)-2-azido-2-[(1S,4R)-4-(benzenesulfonyl)-1-cyclopent-2-enyl]acetic acid IUPAC Name: (2S)-2-azido-2-[(1S,4R)-4-(benzenesulfonyl)cyclopent-2-en-1-yl]acetic acid Traditional Name: (2S)-2-azido-2-[(1S,4R)-4-besylcyclopent-2-en-1-yl]acetic acid Formula: C13H13N3O4S MolecularWeight: 307.32502

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C=CC1S(=O)(=O)C2=CC=CC=C2)C(C(=O)O)N=[N+]=[N-]

Isomeric SMILES

C1[C@@H](C=C[C@@H]1S(=O)(=O)C2=CC=CC=C2)[C@@H](C(=O)O)N=[N+]=[N-]

InChI

InChI=1S/C13H13N3O4S/c14-16-15-12(13(17)18)9-6-7-11(8-9)21(19,20)10-4-2-1-3-5-10/h1-7,9,11-12H,8H2,(H,17,18)/t9-,11+,12+/m1/s1