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

Systemtic Name: 3-(4-methoxyphenyl)carbonyl-6-nitro-3a,4,5,6,7,7a-hexahydro-1,3-benzoxazol-2-one Openeye Name: 3-(4-methoxybenzoyl)-6-nitro-3a,4,5,6,7,7a-hexahydro-1,3-benzoxazol-2-one CAS Name: 3-[(4-methoxyphenyl)-oxomethyl]-6-nitro-3a,4,5,6,7,7a-hexahydro-1,3-benzoxazol-2-one IUPAC Name: 3-(4-methoxybenzoyl)-6-nitro-3a,4,5,6,7,7a-hexahydro-1,3-benzoxazol-2-one Traditional Name: 6-nitro-3-p-anisoyl-3a,4,5,6,7,7a-hexahydro-1,3-benzoxazol-2-one Formula: C15H16N2O6 MolecularWeight: 320.29734

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)N2C3CCC(CC3OC2=O)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)N2C3CCC(CC3OC2=O)[N+](=O)[O-]

InChI

InChI=1S/C15H16N2O6/c1-22-11-5-2-9(3-6-11)14(18)16-12-7-4-10(17(20)21)8-13(12)23-15(16)19/h2-3,5-6,10,12-13H,4,7-8H2,1H3