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

Systemtic Name: (6-ethyl-4-methyl-2-oxidanylidene-chromen-7-yl) 2-azanyl-4-methyl-pentanoate chloride Openeye Name: (6-ethyl-4-methyl-2-oxo-chromen-7-yl) 2-amino-4-methyl-pentanoate chloride CAS Name: 2-amino-4-methylpentanoic 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-4-methylpentanoate chloride Traditional Name: 2-amino-4-methyl-valeric acid (6-ethyl-2-keto-4-methyl-chromen-7-yl) ester chloride Formula: C18H23ClNO4- MolecularWeight: 352.83252

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H23NO4.ClH/c1-5-12-8-13-11(4)7-17(20)22-16(13)9-15(12)23-18(21)14(19)6-10(2)3;/h7-10,14H,5-6,19H2,1-4H3;1H/p-1