3-(4-methylphenyl)carbonyl-3a,4,5,6,7,7a-hexahydro-1,3-benzoxazol-2-one

Systemtic Name: 3-(4-methylphenyl)carbonyl-3a,4,5,6,7,7a-hexahydro-1,3-benzoxazol-2-one Openeye Name: 3-(4-methylbenzoyl)-3a,4,5,6,7,7a-hexahydro-1,3-benzoxazol-2-one CAS Name: 3-[(4-methylphenyl)-oxomethyl]-3a,4,5,6,7,7a-hexahydro-1,3-benzoxazol-2-one IUPAC Name: 3-(4-methylbenzoyl)-3a,4,5,6,7,7a-hexahydro-1,3-benzoxazol-2-one Traditional Name: 3-p-toluoyl-3a,4,5,6,7,7a-hexahydro-1,3-benzoxazol-2-one Formula: C15H17NO3 MolecularWeight: 259.30038

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N2C3CCCCC3OC2=O

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N2C3CCCCC3OC2=O

InChI

InChI=1S/C15H17NO3/c1-10-6-8-11(9-7-10)14(17)16-12-4-2-3-5-13(12)19-15(16)18/h6-9,12-13H,2-5H2,1H3