tert-butyl 4-[[3-(2,3-dihydroindol-1-ylcarbonyl)phenyl]methyl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[[3-(2,3-dihydroindol-1-ylcarbonyl)phenyl]methyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[[3-(indoline-1-carbonyl)phenyl]methyl]piperazine-1-carboxylate CAS Name: 4-[[3-[2,3-dihydroindol-1-yl(oxo)methyl]phenyl]methyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[[3-(2,3-dihydroindole-1-carbonyl)phenyl]methyl]piperazine-1-carboxylate Traditional Name: 4-[3-(indoline-1-carbonyl)benzyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C25H31N3O3 MolecularWeight: 421.53194

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)CC2=CC=CC(=C2)C(=O)N3CCC4=CC=CC=C43

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)CC2=CC=CC(=C2)C(=O)N3CCC4=CC=CC=C43

InChI

InChI=1S/C25H31N3O3/c1-25(2,3)31-24(30)27-15-13-26(14-16-27)18-19-7-6-9-21(17-19)23(29)28-12-11-20-8-4-5-10-22(20)28/h4-10,17H,11-16,18H2,1-3H3