4-[(Z)-(6-chloranyl-4-oxidanylidene-thiochromen-3-ylidene)methyl]benzoic acid

Systemtic Name: 4-[(Z)-(6-chloranyl-4-oxidanylidene-thiochromen-3-ylidene)methyl]benzoic acid Openeye Name: 4-[(Z)-(6-chloro-4-oxo-thiochroman-3-ylidene)methyl]benzoic acid CAS Name: 4-[(Z)-(6-chloro-4-oxo-1-benzothiopyran-3-ylidene)methyl]benzoic acid IUPAC Name: 4-[(Z)-(6-chloro-4-oxothiochromen-3-ylidene)methyl]benzoic acid Traditional Name: 4-[(Z)-(6-chloro-4-keto-thiochroman-3-ylidene)methyl]benzoic acid Formula: C17H11ClO3S MolecularWeight: 330.78544

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=CC2=CC=C(C=C2)C(=O)O)C(=O)C3=C(S1)C=CC(=C3)Cl

Isomeric SMILES

C1/C(=C\C2=CC=C(C=C2)C(=O)O)/C(=O)C3=C(S1)C=CC(=C3)Cl

InChI

InChI=1S/C17H11ClO3S/c18-13-5-6-15-14(8-13)16(19)12(9-22-15)7-10-1-3-11(4-2-10)17(20)21/h1-8H,9H2,(H,20,21)/b12-7+