6-cyano-7-[4-[(3-propan-2-yloxyphenyl)carbamoyl]phenoxy]-3,4-dihydro-2H-chromene-4-carboxylic acid

Systemtic Name: 6-cyano-7-[4-[(3-propan-2-yloxyphenyl)carbamoyl]phenoxy]-3,4-dihydro-2H-chromene-4-carboxylic acid Openeye Name: 6-cyano-7-[4-[(3-isopropoxyphenyl)carbamoyl]phenoxy]chromane-4-carboxylic acid CAS Name: 6-cyano-7-[4-[oxo-(3-propan-2-yloxyanilino)methyl]phenoxy]-3,4-dihydro-2H-1-benzopyran-4-carboxylic acid IUPAC Name: 6-cyano-7-[4-[(3-propan-2-yloxyphenyl)carbamoyl]phenoxy]-3,4-dihydro-2H-chromene-4-carboxylic acid Traditional Name: 6-cyano-7-[4-[(3-isopropoxyphenyl)carbamoyl]phenoxy]chroman-4-carboxylic acid Formula: C27H24N2O6 MolecularWeight: 472.48926

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=CC(=C1)NC(=O)C2=CC=C(C=C2)OC3=CC4=C(C=C3C#N)C(CCO4)C(=O)O

Isomeric SMILES

CC(C)OC1=CC=CC(=C1)NC(=O)C2=CC=C(C=C2)OC3=CC4=C(C=C3C#N)C(CCO4)C(=O)O

InChI

InChI=1S/C27H24N2O6/c1-16(2)34-21-5-3-4-19(13-21)29-26(30)17-6-8-20(9-7-17)35-24-14-25-23(12-18(24)15-28)22(27(31)32)10-11-33-25/h3-9,12-14,16,22H,10-11H2,1-2H3,(H,29,30)(H,31,32)