2-[4-[[4,6-bis(oxidanylidene)-2-sulfanylidene-1,3-diazinan-5-ylidene]methyl]-2-chloranyl-6-methoxy-phenoxy]ethanoic acid

Systemtic Name: 2-[4-[[4,6-bis(oxidanylidene)-2-sulfanylidene-1,3-diazinan-5-ylidene]methyl]-2-chloranyl-6-methoxy-phenoxy]ethanoic acid Openeye Name: 2-[2-chloro-4-[(4,6-dioxo-2-thioxo-hexahydropyrimidin-5-ylidene)methyl]-6-methoxy-phenoxy]acetic acid CAS Name: 2-[2-chloro-4-[(4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene)methyl]-6-methoxyphenoxy]acetic acid IUPAC Name: 2-[2-chloro-4-[(4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene)methyl]-6-methoxyphenoxy]acetic acid Traditional Name: 2-[2-chloro-4-[(4,6-diketo-2-thioxo-hexahydropyrimidin-5-ylidene)methyl]-6-methoxy-phenoxy]acetic acid Formula: C14H11ClN2O6S MolecularWeight: 370.76494

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=C2C(=O)NC(=S)NC2=O)Cl)OCC(=O)O

Isomeric SMILES

COC1=C(C(=CC(=C1)C=C2C(=O)NC(=S)NC2=O)Cl)OCC(=O)O

InChI

InChI=1S/C14H11ClN2O6S/c1-22-9-4-6(3-8(15)11(9)23-5-10(18)19)2-7-12(20)16-14(24)17-13(7)21/h2-4H,5H2,1H3,(H,18,19)(H2,16,17,20,21,24)