cyclohexyl-[4-(4-hydroxyphenyl)-7-oxidanyl-3,4-dihydro-1H-isoquinolin-2-yl]methanone

Systemtic Name: cyclohexyl-[4-(4-hydroxyphenyl)-7-oxidanyl-3,4-dihydro-1H-isoquinolin-2-yl]methanone Openeye Name: cyclohexyl-[7-hydroxy-4-(4-hydroxyphenyl)-3,4-dihydro-1H-isoquinolin-2-yl]methanone CAS Name: cyclohexyl-[7-hydroxy-4-(4-hydroxyphenyl)-3,4-dihydro-1H-isoquinolin-2-yl]methanone IUPAC Name: cyclohexyl-[7-hydroxy-4-(4-hydroxyphenyl)-3,4-dihydro-1H-isoquinolin-2-yl]methanone Traditional Name: cyclohexyl-[7-hydroxy-4-(4-hydroxyphenyl)-3,4-dihydro-1H-isoquinolin-2-yl]methanone Formula: C22H25NO3 MolecularWeight: 351.4388

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)N2CC(C3=C(C2)C=C(C=C3)O)C4=CC=C(C=C4)O

Isomeric SMILES

C1CCC(CC1)C(=O)N2CC(C3=C(C2)C=C(C=C3)O)C4=CC=C(C=C4)O

InChI

InChI=1S/C22H25NO3/c24-18-8-6-15(7-9-18)21-14-23(22(26)16-4-2-1-3-5-16)13-17-12-19(25)10-11-20(17)21/h6-12,16,21,24-25H,1-5,13-14H2