(6-ethyl-4-methyl-2-oxidanylidene-chromen-7-yl) 2-azanyl-3-methyl-butanoate chloride

Systemtic Name: (6-ethyl-4-methyl-2-oxidanylidene-chromen-7-yl) 2-azanyl-3-methyl-butanoate chloride Openeye Name: (6-ethyl-4-methyl-2-oxo-chromen-7-yl) 2-amino-3-methyl-butanoate chloride CAS Name: 2-amino-3-methylbutanoic acid (6-ethyl-4-methyl-2-oxo-1-benzopyran-7-yl) ester chloride IUPAC Name: (6-ethyl-4-methyl-2-oxochromen-7-yl) 2-amino-3-methylbutanoate chloride Traditional Name: 2-amino-3-methyl-butyric acid (6-ethyl-2-keto-4-methyl-chromen-7-yl) ester chloride Formula: C17H21ClNO4- MolecularWeight: 338.80594

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)C)OC(=O)C(C(C)C)N.[Cl-]

Isomeric SMILES

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)C)OC(=O)C(C(C)C)N.[Cl-]

InChI

InChI=1S/C17H21NO4.ClH/c1-5-11-7-12-10(4)6-15(19)21-14(12)8-13(11)22-17(20)16(18)9(2)3;/h6-9,16H,5,18H2,1-4H3;1H/p-1