(2R)-2-[(4-butyl-7-oxidanyl-2-oxidanylidene-chromen-8-yl)methylamino]-4-methyl-pentanoic acid

Systemtic Name: (2R)-2-[(4-butyl-7-oxidanyl-2-oxidanylidene-chromen-8-yl)methylamino]-4-methyl-pentanoic acid Openeye Name: (2R)-2-[(4-butyl-7-hydroxy-2-oxo-chromen-8-yl)methylamino]-4-methyl-pentanoic acid CAS Name: (2R)-2-[(4-butyl-7-hydroxy-2-oxo-1-benzopyran-8-yl)methylamino]-4-methylpentanoic acid IUPAC Name: (2R)-2-[(4-butyl-7-hydroxy-2-oxochromen-8-yl)methylamino]-4-methylpentanoic acid Traditional Name: (2R)-2-[(4-butyl-7-hydroxy-2-keto-chromen-8-yl)methylamino]-4-methyl-valeric acid Formula: C20H27NO5 MolecularWeight: 361.43208

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=O)OC2=C1C=CC(=C2CNC(CC(C)C)C(=O)O)O

Isomeric SMILES

CCCCC1=CC(=O)OC2=C1C=CC(=C2CN[C@H](CC(C)C)C(=O)O)O

InChI

InChI=1S/C20H27NO5/c1-4-5-6-13-10-18(23)26-19-14(13)7-8-17(22)15(19)11-21-16(20(24)25)9-12(2)3/h7-8,10,12,16,21-22H,4-6,9,11H2,1-3H3,(H,24,25)/t16-/m1/s1