sodium 6-chloranyl-7-[4-(2-cyclopropylethylcarbamoyl)phenoxy]-3,4-dihydro-2H-chromene-4-carboxylate

Systemtic Name: sodium 6-chloranyl-7-[4-(2-cyclopropylethylcarbamoyl)phenoxy]-3,4-dihydro-2H-chromene-4-carboxylate Openeye Name: sodium 6-chloro-7-[4-(2-cyclopropylethylcarbamoyl)phenoxy]chromane-4-carboxylate CAS Name: sodium 6-chloro-7-[4-[(2-cyclopropylethylamino)-oxomethyl]phenoxy]-3,4-dihydro-2H-1-benzopyran-4-carboxylate IUPAC Name: sodium 6-chloro-7-[4-(2-cyclopropylethylcarbamoyl)phenoxy]-3,4-dihydro-2H-chromene-4-carboxylate Traditional Name: sodium 6-chloro-7-[4-(2-cyclopropylethylcarbamoyl)phenoxy]chroman-4-carboxylate Formula: C22H21ClNNaO5 MolecularWeight: 437.84861

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1CCNC(=O)C2=CC=C(C=C2)OC3=C(C=C4C(CCOC4=C3)C(=O)[O-])Cl.[Na+]

Isomeric SMILES

C1CC1CCNC(=O)C2=CC=C(C=C2)OC3=C(C=C4C(CCOC4=C3)C(=O)[O-])Cl.[Na+]

InChI

InChI=1S/C22H22ClNO5.Na/c23-18-11-17-16(22(26)27)8-10-28-19(17)12-20(18)29-15-5-3-14(4-6-15)21(25)24-9-7-13-1-2-13;/h3-6,11-13,16H,1-2,7-10H2,(H,24,25)(H,26,27);/q;+1/p-1