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

Systemtic Name: 6-chloranyl-7-[4-(phenethylcarbamoyl)phenoxy]-3,4-dihydro-2H-chromene-4-carboxylic acid Openeye Name: 6-chloro-7-[4-(phenethylcarbamoyl)phenoxy]chromane-4-carboxylic acid CAS Name: 6-chloro-7-[4-[oxo-(phenethylamino)methyl]phenoxy]-3,4-dihydro-2H-1-benzopyran-4-carboxylic acid IUPAC Name: 6-chloro-7-[4-(phenethylcarbamoyl)phenoxy]-3,4-dihydro-2H-chromene-4-carboxylic acid Traditional Name: 6-chloro-7-[4-(phenethylcarbamoyl)phenoxy]chroman-4-carboxylic acid Formula: C25H22ClNO5 MolecularWeight: 451.89888

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=CC(=C(C=C2C1C(=O)O)Cl)OC3=CC=C(C=C3)C(=O)NCCC4=CC=CC=C4

Isomeric SMILES

C1COC2=CC(=C(C=C2C1C(=O)O)Cl)OC3=CC=C(C=C3)C(=O)NCCC4=CC=CC=C4

InChI

InChI=1S/C25H22ClNO5/c26-21-14-20-19(25(29)30)11-13-31-22(20)15-23(21)32-18-8-6-17(7-9-18)24(28)27-12-10-16-4-2-1-3-5-16/h1-9,14-15,19H,10-13H2,(H,27,28)(H,29,30)