2-[[3,5-bis(chloranyl)phenyl]amino]-2-phenoxathiin-4-yl-ethanoic acid

Systemtic Name: 2-[[3,5-bis(chloranyl)phenyl]amino]-2-phenoxathiin-4-yl-ethanoic acid Openeye Name: 2-(3,5-dichloroanilino)-2-phenoxathiin-4-yl-acetic acid CAS Name: 2-(3,5-dichloroanilino)-2-(4-phenoxathiinyl)acetic acid IUPAC Name: 2-(3,5-dichloroanilino)-2-phenoxathiin-4-ylacetic acid Traditional Name: 2-(3,5-dichloroanilino)-2-phenoxathiin-4-yl-acetic acid Formula: C20H13Cl2NO3S MolecularWeight: 418.29312

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)OC3=C(C=CC=C3S2)C(C(=O)O)NC4=CC(=CC(=C4)Cl)Cl

Isomeric SMILES

C1=CC=C2C(=C1)OC3=C(C=CC=C3S2)C(C(=O)O)NC4=CC(=CC(=C4)Cl)Cl

InChI

InChI=1S/C20H13Cl2NO3S/c21-11-8-12(22)10-13(9-11)23-18(20(24)25)14-4-3-7-17-19(14)26-15-5-1-2-6-16(15)27-17/h1-10,18,23H,(H,24,25)