1-[(3S,4R)-4-oxidanyl-3-(phenylmethyl)-3,4-dihydro-2H-chromen-7-yl]cyclopentane-1-carboxylic acid

Systemtic Name: 1-[(3S,4R)-4-oxidanyl-3-(phenylmethyl)-3,4-dihydro-2H-chromen-7-yl]cyclopentane-1-carboxylic acid Openeye Name: 1-[(3S,4R)-3-benzyl-4-hydroxy-chroman-7-yl]cyclopentanecarboxylic acid CAS Name: 1-[(3S,4R)-4-hydroxy-3-(phenylmethyl)-3,4-dihydro-2H-1-benzopyran-7-yl]-1-cyclopentanecarboxylic acid IUPAC Name: 1-[(3S,4R)-3-benzyl-4-hydroxy-3,4-dihydro-2H-chromen-7-yl]cyclopentane-1-carboxylic acid Traditional Name: 1-[(3S,4R)-3-benzyl-4-hydroxy-chroman-7-yl]cyclopentanecarboxylic acid Formula: C22H24O4 MolecularWeight: 352.42356

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)(C2=CC3=C(C=C2)C(C(CO3)CC4=CC=CC=C4)O)C(=O)O

Isomeric SMILES

C1CCC(C1)(C2=CC3=C(C=C2)[C@@H]([C@H](CO3)CC4=CC=CC=C4)O)C(=O)O

InChI

InChI=1S/C22H24O4/c23-20-16(12-15-6-2-1-3-7-15)14-26-19-13-17(8-9-18(19)20)22(21(24)25)10-4-5-11-22/h1-3,6-9,13,16,20,23H,4-5,10-12,14H2,(H,24,25)/t16-,20+/m0/s1