4-[5-[4-(4-propoxyphenyl)phenyl]-1,3-thiazol-2-yl]benzoic acid

Systemtic Name: 4-[5-[4-(4-propoxyphenyl)phenyl]-1,3-thiazol-2-yl]benzoic acid Openeye Name: 4-[5-[4-(4-propoxyphenyl)phenyl]thiazol-2-yl]benzoic acid CAS Name: 4-[5-[4-(4-propoxyphenyl)phenyl]-2-thiazolyl]benzoic acid IUPAC Name: 4-[5-[4-(4-propoxyphenyl)phenyl]-1,3-thiazol-2-yl]benzoic acid Traditional Name: 4-[5-[4-(4-propoxyphenyl)phenyl]thiazol-2-yl]benzoic acid Formula: C25H21NO3S MolecularWeight: 415.50414

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C3=CN=C(S3)C4=CC=C(C=C4)C(=O)O

Isomeric SMILES

CCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C3=CN=C(S3)C4=CC=C(C=C4)C(=O)O

InChI

InChI=1S/C25H21NO3S/c1-2-15-29-22-13-11-18(12-14-22)17-3-5-19(6-4-17)23-16-26-24(30-23)20-7-9-21(10-8-20)25(27)28/h3-14,16H,2,15H2,1H3,(H,27,28)