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

Systemtic Name: 6-chloranyl-7-[4-[(6-phenylpyrazin-2-yl)carbamoyl]phenoxy]-3,4-dihydro-2H-chromene-4-carboxylic acid Openeye Name: 6-chloro-7-[4-[(6-phenylpyrazin-2-yl)carbamoyl]phenoxy]chromane-4-carboxylic acid CAS Name: 6-chloro-7-[4-[oxo-[(6-phenyl-2-pyrazinyl)amino]methyl]phenoxy]-3,4-dihydro-2H-1-benzopyran-4-carboxylic acid IUPAC Name: 6-chloro-7-[4-[(6-phenylpyrazin-2-yl)carbamoyl]phenoxy]-3,4-dihydro-2H-chromene-4-carboxylic acid Traditional Name: 6-chloro-7-[4-[(6-phenylpyrazin-2-yl)carbamoyl]phenoxy]chroman-4-carboxylic acid Formula: C27H20ClN3O5 MolecularWeight: 501.9178

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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)NC4=NC(=CN=C4)C5=CC=CC=C5

Isomeric SMILES

C1COC2=CC(=C(C=C2C1C(=O)O)Cl)OC3=CC=C(C=C3)C(=O)NC4=NC(=CN=C4)C5=CC=CC=C5

InChI

InChI=1S/C27H20ClN3O5/c28-21-12-20-19(27(33)34)10-11-35-23(20)13-24(21)36-18-8-6-17(7-9-18)26(32)31-25-15-29-14-22(30-25)16-4-2-1-3-5-16/h1-9,12-15,19H,10-11H2,(H,33,34)(H,30,31,32)