2-methyl-3-phenylmethoxy-4-(3-thiophen-3-ylpropyl)benzoic acid

Systemtic Name: 2-methyl-3-phenylmethoxy-4-(3-thiophen-3-ylpropyl)benzoic acid Openeye Name: 3-benzyloxy-2-methyl-4-[3-(3-thienyl)propyl]benzoic acid CAS Name: 2-methyl-3-phenylmethoxy-4-[3-(3-thiophenyl)propyl]benzoic acid IUPAC Name: 2-methyl-3-phenylmethoxy-4-(3-thiophen-3-ylpropyl)benzoic acid Traditional Name: 3-benzoxy-2-methyl-4-[3-(3-thienyl)propyl]benzoic acid Formula: C22H22O3S MolecularWeight: 366.47328

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1OCC2=CC=CC=C2)CCCC3=CSC=C3)C(=O)O

Isomeric SMILES

CC1=C(C=CC(=C1OCC2=CC=CC=C2)CCCC3=CSC=C3)C(=O)O

InChI

InChI=1S/C22H22O3S/c1-16-20(22(23)24)11-10-19(9-5-8-18-12-13-26-15-18)21(16)25-14-17-6-3-2-4-7-17/h2-4,6-7,10-13,15H,5,8-9,14H2,1H3,(H,23,24)