[(3S)-3-[(1R)-2-acetyloxy-1-azido-ethyl]pent-4-enyl] benzoate

Systemtic Name: [(3S)-3-[(1R)-2-acetyloxy-1-azido-ethyl]pent-4-enyl] benzoate Openeye Name: [(3S)-3-[(1R)-2-acetoxy-1-azido-ethyl]pent-4-enyl] benzoate CAS Name: benzoic acid [(3S)-3-[(1R)-2-acetyloxy-1-azidoethyl]pent-4-enyl] ester IUPAC Name: [(3S)-3-[(1R)-2-acetyloxy-1-azidoethyl]pent-4-enyl] benzoate Traditional Name: benzoic acid [(3S)-3-[(1R)-2-acetoxy-1-azido-ethyl]pent-4-enyl] ester Formula: C16H19N3O4 MolecularWeight: 317.33976

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC(C(CCOC(=O)C1=CC=CC=C1)C=C)N=[N+]=[N-]

Isomeric SMILES

CC(=O)OC[C@@H]([C@@H](CCOC(=O)C1=CC=CC=C1)C=C)N=[N+]=[N-]

InChI

InChI=1S/C16H19N3O4/c1-3-13(15(18-19-17)11-23-12(2)20)9-10-22-16(21)14-7-5-4-6-8-14/h3-8,13,15H,1,9-11H2,2H3/t13-,15+/m1/s1