[(1R,5S)-3-ethynyl-4-methyl-5-oxidanyl-cyclohex-3-en-1-yl] N-(6-oxidanylhexyl)carbamate

Systemtic Name: [(1R,5S)-3-ethynyl-4-methyl-5-oxidanyl-cyclohex-3-en-1-yl] N-(6-oxidanylhexyl)carbamate Openeye Name: [(1R,5S)-3-ethynyl-5-hydroxy-4-methyl-cyclohex-3-en-1-yl] N-(6-hydroxyhexyl)carbamate CAS Name: N-(6-hydroxyhexyl)carbamic acid [(1R,5S)-3-ethynyl-5-hydroxy-4-methyl-1-cyclohex-3-enyl] ester IUPAC Name: [(1R,5S)-3-ethynyl-5-hydroxy-4-methylcyclohex-3-en-1-yl] N-(6-hydroxyhexyl)carbamate Traditional Name: N-(6-hydroxyhexyl)carbamic acid [(1R,5S)-3-ethynyl-5-hydroxy-4-methyl-cyclohex-3-en-1-yl] ester Formula: C16H25NO4 MolecularWeight: 295.374

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(CC(CC1O)OC(=O)NCCCCCCO)C#C

Isomeric SMILES

CC1=C(C[C@H](C[C@@H]1O)OC(=O)NCCCCCCO)C#C

InChI

InChI=1S/C16H25NO4/c1-3-13-10-14(11-15(19)12(13)2)21-16(20)17-8-6-4-5-7-9-18/h1,14-15,18-19H,4-11H2,2H3,(H,17,20)/t14-,15+/m1/s1