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

Systemtic Name: 4-methyl-2-[(7-oxidanyl-4-oxidanylidene-3-phenoxy-chromen-8-yl)methylamino]pentanoic acid Openeye Name: 2-[(7-hydroxy-4-oxo-3-phenoxy-chromen-8-yl)methylamino]-4-methyl-pentanoic acid CAS Name: 2-[(7-hydroxy-4-oxo-3-phenoxy-1-benzopyran-8-yl)methylamino]-4-methylpentanoic acid IUPAC Name: 2-[(7-hydroxy-4-oxo-3-phenoxychromen-8-yl)methylamino]-4-methylpentanoic acid Traditional Name: 2-[(7-hydroxy-4-keto-3-phenoxy-chromen-8-yl)methylamino]-4-methyl-valeric acid Formula: C22H23NO6 MolecularWeight: 397.42112

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)O)NCC1=C(C=CC2=C1OC=C(C2=O)OC3=CC=CC=C3)O

Isomeric SMILES

CC(C)CC(C(=O)O)NCC1=C(C=CC2=C1OC=C(C2=O)OC3=CC=CC=C3)O

InChI

InChI=1S/C22H23NO6/c1-13(2)10-17(22(26)27)23-11-16-18(24)9-8-15-20(25)19(12-28-21(15)16)29-14-6-4-3-5-7-14/h3-9,12-13,17,23-24H,10-11H2,1-2H3,(H,26,27)