tert-butyl 3-(3,4,5-trimethoxyphenyl)-4,5-dihydrobenzo[g]indazole-2-carboxylate

Systemtic Name: tert-butyl 3-(3,4,5-trimethoxyphenyl)-4,5-dihydrobenzo[g]indazole-2-carboxylate Openeye Name: tert-butyl 3-(3,4,5-trimethoxyphenyl)-4,5-dihydrobenzo[g]indazole-2-carboxylate CAS Name: 3-(3,4,5-trimethoxyphenyl)-4,5-dihydrobenzo[g]indazole-2-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-(3,4,5-trimethoxyphenyl)-4,5-dihydrobenzo[g]indazole-2-carboxylate Traditional Name: 3-(3,4,5-trimethoxyphenyl)-4,5-dihydrobenz[g]indazole-2-carboxylic acid tert-butyl ester Formula: C25H28N2O5 MolecularWeight: 436.50022

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C(=C2CCC3=CC=CC=C3C2=N1)C4=CC(=C(C(=C4)OC)OC)OC

Isomeric SMILES

CC(C)(C)OC(=O)N1C(=C2CCC3=CC=CC=C3C2=N1)C4=CC(=C(C(=C4)OC)OC)OC

InChI

InChI=1S/C25H28N2O5/c1-25(2,3)32-24(28)27-22(16-13-19(29-4)23(31-6)20(14-16)30-5)18-12-11-15-9-7-8-10-17(15)21(18)26-27/h7-10,13-14H,11-12H2,1-6H3