2-[4-methyl-7-oxidanyl-2-oxidanylidene-8-[[(4-propan-2-ylphenyl)amino]methyl]chromen-3-yl]ethanoic acid hydrochloride

Systemtic Name: 2-[4-methyl-7-oxidanyl-2-oxidanylidene-8-[[(4-propan-2-ylphenyl)amino]methyl]chromen-3-yl]ethanoic acid hydrochloride Openeye Name: 2-[7-hydroxy-8-[(4-isopropylanilino)methyl]-4-methyl-2-oxo-chromen-3-yl]acetic acid hydrochloride CAS Name: 2-[7-hydroxy-4-methyl-2-oxo-8-[(4-propan-2-ylanilino)methyl]-1-benzopyran-3-yl]acetic acid hydrochloride IUPAC Name: 2-[7-hydroxy-4-methyl-2-oxo-8-[(4-propan-2-ylanilino)methyl]chromen-3-yl]acetic acid hydrochloride Traditional Name: 2-[8-(cumidinomethyl)-7-hydroxy-2-keto-4-methyl-chromen-3-yl]acetic acid hydrochloride Formula: C22H24ClNO5 MolecularWeight: 417.88266

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=CC(=C2CNC3=CC=C(C=C3)C(C)C)O)CC(=O)O.Cl

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=CC(=C2CNC3=CC=C(C=C3)C(C)C)O)CC(=O)O.Cl

InChI

InChI=1S/C22H23NO5.ClH/c1-12(2)14-4-6-15(7-5-14)23-11-18-19(24)9-8-16-13(3)17(10-20(25)26)22(27)28-21(16)18;/h4-9,12,23-24H,10-11H2,1-3H3,(H,25,26);1H