tert-butyl 3-(2-diethylaminoethyloxy)-5-(hexylamino)-2-methyl-indole-1-carboxylate

Systemtic Name: tert-butyl 3-(2-diethylaminoethyloxy)-5-(hexylamino)-2-methyl-indole-1-carboxylate Openeye Name: tert-butyl 3-(2-diethylaminoethyloxy)-5-(hexylamino)-2-methyl-indole-1-carboxylate CAS Name: 3-(2-diethylaminoethyloxy)-5-(hexylamino)-2-methyl-1-indolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-(2-diethylaminoethyloxy)-5-(hexylamino)-2-methylindole-1-carboxylate Traditional Name: 3-(2-diethylaminoethyloxy)-5-(hexylamino)-2-methyl-indole-1-carboxylic acid tert-butyl ester Formula: C26H43N3O3 MolecularWeight: 445.63792

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC1=CC2=C(C=C1)N(C(=C2OCCN(CC)CC)C)C(=O)OC(C)(C)C

Isomeric SMILES

CCCCCCNC1=CC2=C(C=C1)N(C(=C2OCCN(CC)CC)C)C(=O)OC(C)(C)C

InChI

InChI=1S/C26H43N3O3/c1-8-11-12-13-16-27-21-14-15-23-22(19-21)24(31-18-17-28(9-2)10-3)20(4)29(23)25(30)32-26(5,6)7/h14-15,19,27H,8-13,16-18H2,1-7H3