(3S,4R)-4-oxidanyl-3-(phenylmethyl)-3,4-dihydro-2H-chromene-7-carboxylic acid

Systemtic Name: (3S,4R)-4-oxidanyl-3-(phenylmethyl)-3,4-dihydro-2H-chromene-7-carboxylic acid Openeye Name: (3S,4R)-3-benzyl-4-hydroxy-chromane-7-carboxylic acid CAS Name: (3S,4R)-4-hydroxy-3-(phenylmethyl)-3,4-dihydro-2H-1-benzopyran-7-carboxylic acid IUPAC Name: (3S,4R)-3-benzyl-4-hydroxy-3,4-dihydro-2H-chromene-7-carboxylic acid Traditional Name: (3S,4R)-3-benzyl-4-hydroxy-chroman-7-carboxylic acid Formula: C17H16O4 MolecularWeight: 284.30654

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(C2=C(O1)C=C(C=C2)C(=O)O)O)CC3=CC=CC=C3

Isomeric SMILES

C1[C@@H]([C@H](C2=C(O1)C=C(C=C2)C(=O)O)O)CC3=CC=CC=C3

InChI

InChI=1S/C17H16O4/c18-16-13(8-11-4-2-1-3-5-11)10-21-15-9-12(17(19)20)6-7-14(15)16/h1-7,9,13,16,18H,8,10H2,(H,19,20)/t13-,16+/m0/s1