4-phenyl-5-(phenylmethyl)thiophene-2-carboxylate

Systemtic Name: 4-phenyl-5-(phenylmethyl)thiophene-2-carboxylate Openeye Name: 5-benzyl-4-phenyl-thiophene-2-carboxylate CAS Name: 4-phenyl-5-(phenylmethyl)-2-thiophenecarboxylate IUPAC Name: 5-benzyl-4-phenylthiophene-2-carboxylate Traditional Name: 5-benzyl-4-phenyl-2-thenoate Formula: C18H13O2S- MolecularWeight: 293.35962

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=C(C=C(S2)C(=O)[O-])C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CC2=C(C=C(S2)C(=O)[O-])C3=CC=CC=C3

InChI

InChI=1S/C18H14O2S/c19-18(20)17-12-15(14-9-5-2-6-10-14)16(21-17)11-13-7-3-1-4-8-13/h1-10,12H,11H2,(H,19,20)/p-1