3-methyl-2-[(4-methyl-7-oxidanyl-2-oxidanylidene-chromen-8-yl)methylamino]butanoic acid hydrochloride

Systemtic Name: 3-methyl-2-[(4-methyl-7-oxidanyl-2-oxidanylidene-chromen-8-yl)methylamino]butanoic acid hydrochloride Openeye Name: 2-[(7-hydroxy-4-methyl-2-oxo-chromen-8-yl)methylamino]-3-methyl-butanoic acid hydrochloride CAS Name: 2-[(7-hydroxy-4-methyl-2-oxo-1-benzopyran-8-yl)methylamino]-3-methylbutanoic acid hydrochloride IUPAC Name: 2-[(7-hydroxy-4-methyl-2-oxochromen-8-yl)methylamino]-3-methylbutanoic acid hydrochloride Traditional Name: 2-[(7-hydroxy-2-keto-4-methyl-chromen-8-yl)methylamino]-3-methyl-butyric acid hydrochloride Formula: C16H20ClNO5 MolecularWeight: 341.7867

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=C1C=CC(=C2CNC(C(C)C)C(=O)O)O.Cl

Isomeric SMILES

CC1=CC(=O)OC2=C1C=CC(=C2CNC(C(C)C)C(=O)O)O.Cl

InChI

InChI=1S/C16H19NO5.ClH/c1-8(2)14(16(20)21)17-7-11-12(18)5-4-10-9(3)6-13(19)22-15(10)11;/h4-6,8,14,17-18H,7H2,1-3H3,(H,20,21);1H