tert-butyl 3-[3-azanyl-2-(1H-indol-3-yl)-3-oxidanylidene-propyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 3-[3-azanyl-2-(1H-indol-3-yl)-3-oxidanylidene-propyl]piperidine-1-carboxylate Openeye Name: tert-butyl 3-[3-amino-2-(1H-indol-3-yl)-3-oxo-propyl]piperidine-1-carboxylate CAS Name: 3-[3-amino-2-(1H-indol-3-yl)-3-oxopropyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-[3-amino-2-(1H-indol-3-yl)-3-oxopropyl]piperidine-1-carboxylate Traditional Name: 3-[3-amino-2-(1H-indol-3-yl)-3-keto-propyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C21H29N3O3 MolecularWeight: 371.47326

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCC(C1)CC(C2=CNC3=CC=CC=C32)C(=O)N

Isomeric SMILES

CC(C)(C)OC(=O)N1CCCC(C1)CC(C2=CNC3=CC=CC=C32)C(=O)N

InChI

InChI=1S/C21H29N3O3/c1-21(2,3)27-20(26)24-10-6-7-14(13-24)11-16(19(22)25)17-12-23-18-9-5-4-8-15(17)18/h4-5,8-9,12,14,16,23H,6-7,10-11,13H2,1-3H3,(H2,22,25)