ethyl 3-(4-fluorophenyl)-8-methoxy-3,3a,4,5-tetrahydrobenzo[g]indazole-2-carboxylate

Systemtic Name: ethyl 3-(4-fluorophenyl)-8-methoxy-3,3a,4,5-tetrahydrobenzo[g]indazole-2-carboxylate Openeye Name: ethyl 3-(4-fluorophenyl)-8-methoxy-3,3a,4,5-tetrahydrobenzo[g]indazole-2-carboxylate CAS Name: 3-(4-fluorophenyl)-8-methoxy-3,3a,4,5-tetrahydrobenzo[g]indazole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 3-(4-fluorophenyl)-8-methoxy-3,3a,4,5-tetrahydrobenzo[g]indazole-2-carboxylate Traditional Name: 3-(4-fluorophenyl)-8-methoxy-3,3a,4,5-tetrahydrobenz[g]indazole-2-carboxylic acid ethyl ester Formula: C21H21FN2O3 MolecularWeight: 368.401443

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1C(C2CCC3=C(C2=N1)C=C(C=C3)OC)C4=CC=C(C=C4)F

Isomeric SMILES

CCOC(=O)N1C(C2CCC3=C(C2=N1)C=C(C=C3)OC)C4=CC=C(C=C4)F

InChI

InChI=1S/C21H21FN2O3/c1-3-27-21(25)24-20(14-4-8-15(22)9-5-14)17-11-7-13-6-10-16(26-2)12-18(13)19(17)23-24/h4-6,8-10,12,17,20H,3,7,11H2,1-2H3