1-(5-phenyl-3a,4,5,6,7,7a-hexahydro-1,2-benzoxazol-3-yl)dodecan-1-one

Systemtic Name: 1-(5-phenyl-3a,4,5,6,7,7a-hexahydro-1,2-benzoxazol-3-yl)dodecan-1-one Openeye Name: 1-(5-phenyl-3a,4,5,6,7,7a-hexahydro-1,2-benzoxazol-3-yl)dodecan-1-one CAS Name: 1-(5-phenyl-3a,4,5,6,7,7a-hexahydro-1,2-benzoxazol-3-yl)-1-dodecanone IUPAC Name: 1-(5-phenyl-3a,4,5,6,7,7a-hexahydro-1,2-benzoxazol-3-yl)dodecan-1-one Traditional Name: 1-(5-phenyl-3a,4,5,6,7,7a-hexahydroindoxazen-3-yl)dodecan-1-one Formula: C25H37NO2 MolecularWeight: 383.56678

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)C1=NOC2C1CC(CC2)C3=CC=CC=C3

Isomeric SMILES

CCCCCCCCCCCC(=O)C1=NOC2C1CC(CC2)C3=CC=CC=C3

InChI

InChI=1S/C25H37NO2/c1-2-3-4-5-6-7-8-9-13-16-23(27)25-22-19-21(17-18-24(22)28-26-25)20-14-11-10-12-15-20/h10-12,14-15,21-22,24H,2-9,13,16-19H2,1H3