4-[3,3-bis(3-fluoranyl-4-methoxy-phenyl)benzo[f]chromen-6-yl]thiomorpholine

Systemtic Name: 4-[3,3-bis(3-fluoranyl-4-methoxy-phenyl)benzo[f]chromen-6-yl]thiomorpholine Openeye Name: 4-[3,3-bis(3-fluoro-4-methoxy-phenyl)benzo[f]chromen-6-yl]thiomorpholine CAS Name: 4-[3,3-bis(3-fluoro-4-methoxyphenyl)-6-benzo[f][1]benzopyranyl]thiomorpholine IUPAC Name: 4-[3,3-bis(3-fluoro-4-methoxyphenyl)benzo[f]chromen-6-yl]thiomorpholine Traditional Name: 4-[3,3-bis(3-fluoro-4-methoxy-phenyl)benzo[f]chromen-6-yl]thiomorpholine Formula: C31H27F2NO3S MolecularWeight: 531.612786

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2(C=CC3=C(O2)C=C(C4=CC=CC=C34)N5CCSCC5)C6=CC(=C(C=C6)OC)F)F

Isomeric SMILES

COC1=C(C=C(C=C1)C2(C=CC3=C(O2)C=C(C4=CC=CC=C34)N5CCSCC5)C6=CC(=C(C=C6)OC)F)F

InChI

InChI=1S/C31H27F2NO3S/c1-35-28-9-7-20(17-25(28)32)31(21-8-10-29(36-2)26(33)18-21)12-11-24-22-5-3-4-6-23(22)27(19-30(24)37-31)34-13-15-38-16-14-34/h3-12,17-19H,13-16H2,1-2H3