(2R)-2-[(4-methyl-7-oxidanyl-2-oxidanylidene-chromen-8-yl)methylazaniumyl]-5-[(2-methylpropan-2-yl)oxy]-5-oxidanylidene-pentanoate

Systemtic Name: (2R)-2-[(4-methyl-7-oxidanyl-2-oxidanylidene-chromen-8-yl)methylazaniumyl]-5-[(2-methylpropan-2-yl)oxy]-5-oxidanylidene-pentanoate Openeye Name: (2R)-5-tert-butoxy-2-[(7-hydroxy-4-methyl-2-oxo-chromen-8-yl)methylammonio]-5-oxo-pentanoate CAS Name: (2R)-2-[(7-hydroxy-4-methyl-2-oxo-1-benzopyran-8-yl)methylammonio]-5-[(2-methylpropan-2-yl)oxy]-5-oxopentanoate IUPAC Name: (2R)-2-[(7-hydroxy-4-methyl-2-oxochromen-8-yl)methylazaniumyl]-5-[(2-methylpropan-2-yl)oxy]-5-oxopentanoate Traditional Name: (2R)-5-tert-butoxy-2-[(7-hydroxy-2-keto-4-methyl-chromen-8-yl)methylammonio]-5-keto-valerate Formula: C20H25NO7 MolecularWeight: 391.415

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=C1C=CC(=C2C[NH2+]C(CCC(=O)OC(C)(C)C)C(=O)[O-])O

Isomeric SMILES

CC1=CC(=O)OC2=C1C=CC(=C2C[NH2+][C@H](CCC(=O)OC(C)(C)C)C(=O)[O-])O

InChI

InChI=1S/C20H25NO7/c1-11-9-17(24)27-18-12(11)5-7-15(22)13(18)10-21-14(19(25)26)6-8-16(23)28-20(2,3)4/h5,7,9,14,21-22H,6,8,10H2,1-4H3,(H,25,26)/t14-/m1/s1