(2S,3R)-2-[(1S,3S)-3-azido-1-oxidanyl-nonyl]-3-prop-2-enyl-cyclohexan-1-one

Systemtic Name: (2S,3R)-2-[(1S,3S)-3-azido-1-oxidanyl-nonyl]-3-prop-2-enyl-cyclohexan-1-one Openeye Name: (2S,3R)-3-allyl-2-[(1S,3S)-3-azido-1-hydroxy-nonyl]cyclohexanone CAS Name: (2S,3R)-2-[(1S,3S)-3-azido-1-hydroxynonyl]-3-prop-2-enyl-1-cyclohexanone IUPAC Name: (2S,3R)-2-[(1S,3S)-3-azido-1-hydroxynonyl]-3-prop-2-enylcyclohexan-1-one Traditional Name: (2S,3R)-3-allyl-2-[(1S,3S)-3-azido-1-hydroxy-nonyl]cyclohexanone Formula: C18H31N3O2 MolecularWeight: 321.45764

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(CC(C1C(CCCC1=O)CC=C)O)N=[N+]=[N-]

Isomeric SMILES

CCCCCC[C@@H](C[C@@H]([C@@H]1[C@H](CCCC1=O)CC=C)O)N=[N+]=[N-]

InChI

InChI=1S/C18H31N3O2/c1-3-5-6-7-11-15(20-21-19)13-17(23)18-14(9-4-2)10-8-12-16(18)22/h4,14-15,17-18,23H,2-3,5-13H2,1H3/t14-,15-,17-,18+/m0/s1