tert-butyl N-[(E,4S,5R)-3,8-dimethyl-5-oxidanyl-non-6-en-4-yl]carbamate

Systemtic Name: tert-butyl N-[(E,4S,5R)-3,8-dimethyl-5-oxidanyl-non-6-en-4-yl]carbamate Openeye Name: tert-butyl N-[(E,1S,2R)-2-hydroxy-5-methyl-1-sec-butyl-hex-3-enyl]carbamate CAS Name: N-[(E,4S,5R)-5-hydroxy-3,8-dimethylnon-6-en-4-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(E,4S,5R)-5-hydroxy-3,8-dimethylnon-6-en-4-yl]carbamate Traditional Name: N-[(E,1S,2R)-2-hydroxy-5-methyl-1-sec-butyl-hex-3-enyl]carbamic acid tert-butyl ester Formula: C16H31NO3 MolecularWeight: 285.42224

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(C=CC(C)C)O)NC(=O)OC(C)(C)C

Isomeric SMILES

CCC(C)[C@@H]([C@@H](/C=C/C(C)C)O)NC(=O)OC(C)(C)C

InChI

InChI=1S/C16H31NO3/c1-8-12(4)14(13(18)10-9-11(2)3)17-15(19)20-16(5,6)7/h9-14,18H,8H2,1-7H3,(H,17,19)/b10-9+/t12?,13-,14+/m1/s1