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

Systemtic Name: 4-methyl-2-[(2-methyl-7-oxidanyl-4-oxidanylidene-3-phenoxy-chromen-8-yl)methylamino]pentanoic acid Openeye Name: 2-[(7-hydroxy-2-methyl-4-oxo-3-phenoxy-chromen-8-yl)methylamino]-4-methyl-pentanoic acid CAS Name: 2-[(7-hydroxy-2-methyl-4-oxo-3-phenoxy-1-benzopyran-8-yl)methylamino]-4-methylpentanoic acid IUPAC Name: 2-[(7-hydroxy-2-methyl-4-oxo-3-phenoxychromen-8-yl)methylamino]-4-methylpentanoic acid Traditional Name: 2-[(7-hydroxy-4-keto-2-methyl-3-phenoxy-chromen-8-yl)methylamino]-4-methyl-valeric acid Formula: C23H25NO6 MolecularWeight: 411.4477

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C2=C(O1)C(=C(C=C2)O)CNC(CC(C)C)C(=O)O)OC3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=O)C2=C(O1)C(=C(C=C2)O)CNC(CC(C)C)C(=O)O)OC3=CC=CC=C3

InChI

InChI=1S/C23H25NO6/c1-13(2)11-18(23(27)28)24-12-17-19(25)10-9-16-20(26)21(14(3)29-22(16)17)30-15-7-5-4-6-8-15/h4-10,13,18,24-25H,11-12H2,1-3H3,(H,27,28)