2-[(4-methanoyl-2-phenyl-2H-chromen-3-yl)sulfanyl]ethanoic acid

Systemtic Name: 2-[(4-methanoyl-2-phenyl-2H-chromen-3-yl)sulfanyl]ethanoic acid Openeye Name: 2-[(4-formyl-2-phenyl-2H-chromen-3-yl)sulfanyl]acetic acid CAS Name: 2-[(4-formyl-2-phenyl-2H-1-benzopyran-3-yl)thio]acetic acid IUPAC Name: 2-[(4-formyl-2-phenyl-2H-chromen-3-yl)sulfanyl]acetic acid Traditional Name: 2-[(4-formyl-2-phenyl-2H-chromen-3-yl)thio]acetic acid Formula: C18H14O4S MolecularWeight: 326.36636

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2C(=C(C3=CC=CC=C3O2)C=O)SCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2C(=C(C3=CC=CC=C3O2)C=O)SCC(=O)O

InChI

InChI=1S/C18H14O4S/c19-10-14-13-8-4-5-9-15(13)22-17(12-6-2-1-3-7-12)18(14)23-11-16(20)21/h1-10,17H,11H2,(H,20,21)