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

Systemtic Name: 6-chloranyl-7-[4-[(3-phenylcyclobutyl)carbamoyl]phenoxy]-3,4-dihydro-2H-chromene-4-carboxylic acid Openeye Name: 6-chloro-7-[4-[(3-phenylcyclobutyl)carbamoyl]phenoxy]chromane-4-carboxylic acid CAS Name: 6-chloro-7-[4-[oxo-[(3-phenylcyclobutyl)amino]methyl]phenoxy]-3,4-dihydro-2H-1-benzopyran-4-carboxylic acid IUPAC Name: 6-chloro-7-[4-[(3-phenylcyclobutyl)carbamoyl]phenoxy]-3,4-dihydro-2H-chromene-4-carboxylic acid Traditional Name: 6-chloro-7-[4-[(3-phenylcyclobutyl)carbamoyl]phenoxy]chroman-4-carboxylic acid Formula: C27H24ClNO5 MolecularWeight: 477.93616

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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)NC4CC(C4)C5=CC=CC=C5

Isomeric SMILES

C1COC2=CC(=C(C=C2C1C(=O)O)Cl)OC3=CC=C(C=C3)C(=O)NC4CC(C4)C5=CC=CC=C5

InChI

InChI=1S/C27H24ClNO5/c28-23-14-22-21(27(31)32)10-11-33-24(22)15-25(23)34-20-8-6-17(7-9-20)26(30)29-19-12-18(13-19)16-4-2-1-3-5-16/h1-9,14-15,18-19,21H,10-13H2,(H,29,30)(H,31,32)