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

Systemtic Name: 6-chloranyl-7-[4-(3-phenylpropylcarbamoyl)phenoxy]-3,4-dihydro-2H-chromene-4-carboxylic acid Openeye Name: 6-chloro-7-[4-(3-phenylpropylcarbamoyl)phenoxy]chromane-4-carboxylic acid CAS Name: 6-chloro-7-[4-[oxo-(3-phenylpropylamino)methyl]phenoxy]-3,4-dihydro-2H-1-benzopyran-4-carboxylic acid IUPAC Name: 6-chloro-7-[4-(3-phenylpropylcarbamoyl)phenoxy]-3,4-dihydro-2H-chromene-4-carboxylic acid Traditional Name: 6-chloro-7-[4-(3-phenylpropylcarbamoyl)phenoxy]chroman-4-carboxylic acid Formula: C26H24ClNO5 MolecularWeight: 465.92546

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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)NCCCC4=CC=CC=C4

Isomeric SMILES

C1COC2=CC(=C(C=C2C1C(=O)O)Cl)OC3=CC=C(C=C3)C(=O)NCCCC4=CC=CC=C4

InChI

InChI=1S/C26H24ClNO5/c27-22-15-21-20(26(30)31)12-14-32-23(21)16-24(22)33-19-10-8-18(9-11-19)25(29)28-13-4-7-17-5-2-1-3-6-17/h1-3,5-6,8-11,15-16,20H,4,7,12-14H2,(H,28,29)(H,30,31)