tert-butyl 8-(chloromethyl)-1-methyl-4-phenylmethoxy-7,8-dihydro-2H-pyrrolo[3,2-e]indazole-6-carboxylate

Systemtic Name: tert-butyl 8-(chloromethyl)-1-methyl-4-phenylmethoxy-7,8-dihydro-2H-pyrrolo[3,2-e]indazole-6-carboxylate Openeye Name: tert-butyl 4-benzyloxy-8-(chloromethyl)-1-methyl-7,8-dihydro-2H-pyrrolo[3,2-e]indazole-6-carboxylate CAS Name: 8-(chloromethyl)-1-methyl-4-phenylmethoxy-7,8-dihydro-2H-pyrrolo[3,2-e]indazole-6-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 8-(chloromethyl)-1-methyl-4-phenylmethoxy-7,8-dihydro-2H-pyrrolo[3,2-e]indazole-6-carboxylate Traditional Name: 4-benzoxy-8-(chloromethyl)-1-methyl-7,8-dihydro-2H-pyrrol[3,2-e]indazole-6-carboxylic acid tert-butyl ester Formula: C23H26ClN3O3 MolecularWeight: 427.92384

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C3=C(C=C(C2=NN1)OCC4=CC=CC=C4)N(CC3CCl)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=C2C3=C(C=C(C2=NN1)OCC4=CC=CC=C4)N(CC3CCl)C(=O)OC(C)(C)C

InChI

InChI=1S/C23H26ClN3O3/c1-14-19-20-16(11-24)12-27(22(28)30-23(2,3)4)17(20)10-18(21(19)26-25-14)29-13-15-8-6-5-7-9-15/h5-10,16H,11-13H2,1-4H3,(H,25,26)