methyl (E)-4-[(3S,6R)-6-butyl-1,2-oxazinan-3-yl]but-3-enoate

Systemtic Name: methyl (E)-4-[(3S,6R)-6-butyl-1,2-oxazinan-3-yl]but-3-enoate Openeye Name: methyl (E)-4-[(3S,6R)-6-butyloxazinan-3-yl]but-3-enoate CAS Name: (E)-4-[(3S,6R)-6-butyl-3-oxazinanyl]-3-butenoic acid methyl ester IUPAC Name: methyl (E)-4-[(3S,6R)-6-butyloxazinan-3-yl]but-3-enoate Traditional Name: (E)-4-[(3S,6R)-6-butyloxazinan-3-yl]but-3-enoic acid methyl ester Formula: C13H23NO3 MolecularWeight: 241.32662

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CCC(NO1)C=CCC(=O)OC

Isomeric SMILES

CCCC[C@@H]1CC[C@H](NO1)/C=C/CC(=O)OC

InChI

InChI=1S/C13H23NO3/c1-3-4-7-12-10-9-11(14-17-12)6-5-8-13(15)16-2/h5-6,11-12,14H,3-4,7-10H2,1-2H3/b6-5+/t11-,12-/m1/s1