2-aminocarbonyl-4-(2-methylphenyl)-2-[3-(thiophen-3-ylmethoxy)phenoxy]butanoic acid

Systemtic Name: 2-aminocarbonyl-4-(2-methylphenyl)-2-[3-(thiophen-3-ylmethoxy)phenoxy]butanoic acid Openeye Name: 2-carbamoyl-4-(o-tolyl)-2-[3-(3-thienylmethoxy)phenoxy]butanoic acid CAS Name: 2-carbamoyl-4-(2-methylphenyl)-2-[3-(3-thiophenylmethoxy)phenoxy]butanoic acid IUPAC Name: 2-carbamoyl-4-(2-methylphenyl)-2-[3-(thiophen-3-ylmethoxy)phenoxy]butanoic acid Traditional Name: 2-carbamoyl-4-(o-tolyl)-2-[3-(3-thenyloxy)phenoxy]butyric acid Formula: C23H23NO5S MolecularWeight: 425.49742

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CCC(C(=O)N)(C(=O)O)OC2=CC=CC(=C2)OCC3=CSC=C3

Isomeric SMILES

CC1=CC=CC=C1CCC(C(=O)N)(C(=O)O)OC2=CC=CC(=C2)OCC3=CSC=C3

InChI

InChI=1S/C23H23NO5S/c1-16-5-2-3-6-18(16)9-11-23(21(24)25,22(26)27)29-20-8-4-7-19(13-20)28-14-17-10-12-30-15-17/h2-8,10,12-13,15H,9,11,14H2,1H3,(H2,24,25)(H,26,27)