tert-butyl 5-[4-(4-methoxycarbonyl-8-methyl-8-azabicyclo[3.2.1]octan-3-yl)phenyl]indole-1-carboxylate

Systemtic Name: tert-butyl 5-[4-(4-methoxycarbonyl-8-methyl-8-azabicyclo[3.2.1]octan-3-yl)phenyl]indole-1-carboxylate Openeye Name: tert-butyl 5-[4-(4-methoxycarbonyl-8-methyl-8-azabicyclo[3.2.1]octan-3-yl)phenyl]indole-1-carboxylate CAS Name: 5-[4-(4-methoxycarbonyl-8-methyl-8-azabicyclo[3.2.1]octan-3-yl)phenyl]-1-indolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 5-[4-(4-methoxycarbonyl-8-methyl-8-azabicyclo[3.2.1]octan-3-yl)phenyl]indole-1-carboxylate Traditional Name: 5-[4-(4-carbomethoxy-8-methyl-8-azabicyclo[3.2.1]octan-3-yl)phenyl]indole-1-carboxylic acid tert-butyl ester Formula: C29H34N2O4 MolecularWeight: 474.59126

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C=CC2=C1C=CC(=C2)C3=CC=C(C=C3)C4CC5CCC(C4C(=O)OC)N5C

Isomeric SMILES

CC(C)(C)OC(=O)N1C=CC2=C1C=CC(=C2)C3=CC=C(C=C3)C4CC5CCC(C4C(=O)OC)N5C

InChI

InChI=1S/C29H34N2O4/c1-29(2,3)35-28(33)31-15-14-21-16-20(10-12-24(21)31)18-6-8-19(9-7-18)23-17-22-11-13-25(30(22)4)26(23)27(32)34-5/h6-10,12,14-16,22-23,25-26H,11,13,17H2,1-5H3