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

Systemtic Name: 3-methyl-2-[(7-oxidanyl-2-oxidanylidene-4-propyl-chromen-8-yl)methylamino]pentanoic acid Openeye Name: 2-[(7-hydroxy-2-oxo-4-propyl-chromen-8-yl)methylamino]-3-methyl-pentanoic acid CAS Name: 2-[(7-hydroxy-2-oxo-4-propyl-1-benzopyran-8-yl)methylamino]-3-methylpentanoic acid IUPAC Name: 2-[(7-hydroxy-2-oxo-4-propylchromen-8-yl)methylamino]-3-methylpentanoic acid Traditional Name: 2-[(7-hydroxy-2-keto-4-propyl-chromen-8-yl)methylamino]-3-methyl-valeric acid Formula: C19H25NO5 MolecularWeight: 347.4055

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)OC2=C1C=CC(=C2CNC(C(C)CC)C(=O)O)O

Isomeric SMILES

CCCC1=CC(=O)OC2=C1C=CC(=C2CNC(C(C)CC)C(=O)O)O

InChI

InChI=1S/C19H25NO5/c1-4-6-12-9-16(22)25-18-13(12)7-8-15(21)14(18)10-20-17(19(23)24)11(3)5-2/h7-9,11,17,20-21H,4-6,10H2,1-3H3,(H,23,24)