7-[3-(2-chloranyl-4-phenoxy-phenoxy)propoxy]-3,4-dihydro-2H-chromene-2-carboxylic acid

Systemtic Name: 7-[3-(2-chloranyl-4-phenoxy-phenoxy)propoxy]-3,4-dihydro-2H-chromene-2-carboxylic acid Openeye Name: 7-[3-(2-chloro-4-phenoxy-phenoxy)propoxy]chromane-2-carboxylic acid CAS Name: 7-[3-(2-chloro-4-phenoxyphenoxy)propoxy]-3,4-dihydro-2H-1-benzopyran-2-carboxylic acid IUPAC Name: 7-[3-(2-chloro-4-phenoxyphenoxy)propoxy]-3,4-dihydro-2H-chromene-2-carboxylic acid Traditional Name: 7-[3-(2-chloro-4-phenoxy-phenoxy)propoxy]chroman-2-carboxylic acid Formula: C25H23ClO6 MolecularWeight: 454.89952

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=C(C=C2)OCCCOC3=C(C=C(C=C3)OC4=CC=CC=C4)Cl)OC1C(=O)O

Isomeric SMILES

C1CC2=C(C=C(C=C2)OCCCOC3=C(C=C(C=C3)OC4=CC=CC=C4)Cl)OC1C(=O)O

InChI

InChI=1S/C25H23ClO6/c26-21-15-20(31-18-5-2-1-3-6-18)10-12-22(21)30-14-4-13-29-19-9-7-17-8-11-23(25(27)28)32-24(17)16-19/h1-3,5-7,9-10,12,15-16,23H,4,8,11,13-14H2,(H,27,28)