3-[2-methyl-5-oxidanyl-7-(5-phenylpentan-2-yl)-3,4-dihydro-2H-chromen-4-yl]butanoic acid

Systemtic Name: 3-[2-methyl-5-oxidanyl-7-(5-phenylpentan-2-yl)-3,4-dihydro-2H-chromen-4-yl]butanoic acid Openeye Name: 3-[5-hydroxy-2-methyl-7-(1-methyl-4-phenyl-butyl)chroman-4-yl]butanoic acid CAS Name: 3-[5-hydroxy-2-methyl-7-(5-phenylpentan-2-yl)-3,4-dihydro-2H-1-benzopyran-4-yl]butanoic acid IUPAC Name: 3-[5-hydroxy-2-methyl-7-(5-phenylpentan-2-yl)-3,4-dihydro-2H-chromen-4-yl]butanoic acid Traditional Name: 3-[5-hydroxy-2-methyl-7-(1-methyl-4-phenyl-butyl)chroman-4-yl]butyric acid Formula: C25H32O4 MolecularWeight: 396.51918

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(C2=C(O1)C=C(C=C2O)C(C)CCCC3=CC=CC=C3)C(C)CC(=O)O

Isomeric SMILES

CC1CC(C2=C(O1)C=C(C=C2O)C(C)CCCC3=CC=CC=C3)C(C)CC(=O)O

InChI

InChI=1S/C25H32O4/c1-16(8-7-11-19-9-5-4-6-10-19)20-14-22(26)25-21(17(2)12-24(27)28)13-18(3)29-23(25)15-20/h4-6,9-10,14-18,21,26H,7-8,11-13H2,1-3H3,(H,27,28)