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

Systemtic Name: 2-[4-oxidanyl-3-(phenylmethyl)-3,4-dihydro-2H-chromen-7-yl]cyclohexane-1-carboxylic acid Openeye Name: 2-(3-benzyl-4-hydroxy-chroman-7-yl)cyclohexanecarboxylic acid CAS Name: 2-[4-hydroxy-3-(phenylmethyl)-3,4-dihydro-2H-1-benzopyran-7-yl]-1-cyclohexanecarboxylic acid IUPAC Name: 2-(3-benzyl-4-hydroxy-3,4-dihydro-2H-chromen-7-yl)cyclohexane-1-carboxylic acid Traditional Name: 2-(3-benzyl-4-hydroxy-chroman-7-yl)cyclohexanecarboxylic acid Formula: C23H26O4 MolecularWeight: 366.45014

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H26O4/c24-22-17(12-15-6-2-1-3-7-15)14-27-21-13-16(10-11-20(21)22)18-8-4-5-9-19(18)23(25)26/h1-3,6-7,10-11,13,17-19,22,24H,4-5,8-9,12,14H2,(H,25,26)