4-[2-(carboxycarbonyl)-5-(thiophen-3-ylmethoxy)phenoxy]-4-(2-methylphenyl)butanoate

Systemtic Name: 4-[2-(carboxycarbonyl)-5-(thiophen-3-ylmethoxy)phenoxy]-4-(2-methylphenyl)butanoate Openeye Name: 4-(o-tolyl)-4-[2-oxalo-5-(3-thienylmethoxy)phenoxy]butanoate CAS Name: 4-(2-methylphenyl)-4-[2-oxalo-5-(3-thiophenylmethoxy)phenoxy]butanoate IUPAC Name: 4-(2-methylphenyl)-4-[2-oxalo-5-(thiophen-3-ylmethoxy)phenoxy]butanoate Traditional Name: 4-(o-tolyl)-4-[2-oxalo-5-(3-thenyloxy)phenoxy]butyrate Formula: C24H21O7S- MolecularWeight: 453.48434

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(CCC(=O)[O-])OC2=C(C=CC(=C2)OCC3=CSC=C3)C(=O)C(=O)O

Isomeric SMILES

CC1=CC=CC=C1C(CCC(=O)[O-])OC2=C(C=CC(=C2)OCC3=CSC=C3)C(=O)C(=O)O

InChI

InChI=1S/C24H22O7S/c1-15-4-2-3-5-18(15)20(8-9-22(25)26)31-21-12-17(30-13-16-10-11-32-14-16)6-7-19(21)23(27)24(28)29/h2-7,10-12,14,20H,8-9,13H2,1H3,(H,25,26)(H,28,29)/p-1