3-(4-methoxyphenyl)-4-sulfanyl-1,3-benzoxazine-2,5-dione

Systemtic Name: 3-(4-methoxyphenyl)-4-sulfanyl-1,3-benzoxazine-2,5-dione Openeye Name: 3-(4-methoxyphenyl)-4-sulfanyl-1,3-benzoxazine-2,5-dione CAS Name: 4-mercapto-3-(4-methoxyphenyl)-1,3-benzoxazine-2,5-dione IUPAC Name: 3-(4-methoxyphenyl)-4-sulfanyl-1,3-benzoxazine-2,5-dione Traditional Name: 4-mercapto-3-(4-methoxyphenyl)-1,3-benzoxazine-2,5-quinone Formula: C15H11NO4S MolecularWeight: 301.31714

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(=C3C(=O)C=CC=C3OC2=O)S

Isomeric SMILES

COC1=CC=C(C=C1)N2C(=C3C(=O)C=CC=C3OC2=O)S

InChI

InChI=1S/C15H11NO4S/c1-19-10-7-5-9(6-8-10)16-14(21)13-11(17)3-2-4-12(13)20-15(16)18/h2-8,21H,1H3