methyl 1-fluoranyl-3-methanoyl-6-(4-methoxyphenyl)-6-(4-pyrrolidin-1-ylphenyl)-5H-phenanthrene-9-carboxylate

Systemtic Name: methyl 1-fluoranyl-3-methanoyl-6-(4-methoxyphenyl)-6-(4-pyrrolidin-1-ylphenyl)-5H-phenanthrene-9-carboxylate Openeye Name: methyl 1-fluoro-3-formyl-6-(4-methoxyphenyl)-6-(4-pyrrolidin-1-ylphenyl)-5H-phenanthrene-9-carboxylate CAS Name: 1-fluoro-3-formyl-6-(4-methoxyphenyl)-6-[4-(1-pyrrolidinyl)phenyl]-5H-phenanthrene-9-carboxylic acid methyl ester IUPAC Name: methyl 1-fluoro-3-formyl-6-(4-methoxyphenyl)-6-(4-pyrrolidin-1-ylphenyl)-5H-phenanthrene-9-carboxylate Traditional Name: 1-fluoro-3-formyl-6-(4-methoxyphenyl)-6-(4-pyrrolidinophenyl)-5H-phenanthrene-9-carboxylic acid methyl ester Formula: C34H30FNO4 MolecularWeight: 535.604703

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2(CC3=C(C=C2)C(=CC4=C(C=C(C=C34)C=O)F)C(=O)OC)C5=CC=C(C=C5)N6CCCC6

Isomeric SMILES

COC1=CC=C(C=C1)C2(CC3=C(C=C2)C(=CC4=C(C=C(C=C34)C=O)F)C(=O)OC)C5=CC=C(C=C5)N6CCCC6

InChI

InChI=1S/C34H30FNO4/c1-39-26-11-7-24(8-12-26)34(23-5-9-25(10-6-23)36-15-3-4-16-36)14-13-27-30(33(38)40-2)19-29-28(31(27)20-34)17-22(21-37)18-32(29)35/h5-14,17-19,21H,3-4,15-16,20H2,1-2H3