methyl 1-(4-bromophenyl)-7-methoxy-3-oxidanyl-9,10-dihydrophenanthrene-4-carboxylate

Systemtic Name: methyl 1-(4-bromophenyl)-7-methoxy-3-oxidanyl-9,10-dihydrophenanthrene-4-carboxylate Openeye Name: methyl 1-(4-bromophenyl)-3-hydroxy-7-methoxy-9,10-dihydrophenanthrene-4-carboxylate CAS Name: 1-(4-bromophenyl)-3-hydroxy-7-methoxy-9,10-dihydrophenanthrene-4-carboxylic acid methyl ester IUPAC Name: methyl 1-(4-bromophenyl)-3-hydroxy-7-methoxy-9,10-dihydrophenanthrene-4-carboxylate Traditional Name: 1-(4-bromophenyl)-3-hydroxy-7-methoxy-9,10-dihydrophenanthrene-4-carboxylic acid methyl ester Formula: C23H19BrO4 MolecularWeight: 439.29856

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C3=C(CC2)C(=CC(=C3C(=O)OC)O)C4=CC=C(C=C4)Br

Isomeric SMILES

COC1=CC2=C(C=C1)C3=C(CC2)C(=CC(=C3C(=O)OC)O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C23H19BrO4/c1-27-16-8-10-17-14(11-16)5-9-18-19(13-3-6-15(24)7-4-13)12-20(25)22(21(17)18)23(26)28-2/h3-4,6-8,10-12,25H,5,9H2,1-2H3