tert-butyl 3-[[2-(1H-indol-3-yl)ethanoylamino]carbamoyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 3-[[2-(1H-indol-3-yl)ethanoylamino]carbamoyl]piperidine-1-carboxylate Openeye Name: tert-butyl 3-[[[2-(1H-indol-3-yl)acetyl]amino]carbamoyl]piperidine-1-carboxylate CAS Name: 3-[[[2-(1H-indol-3-yl)-1-oxoethyl]hydrazo]-oxomethyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-[[[2-(1H-indol-3-yl)acetyl]amino]carbamoyl]piperidine-1-carboxylate Traditional Name: 3-[[[2-(1H-indol-3-yl)acetyl]amino]carbamoyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C21H28N4O4 MolecularWeight: 400.47142

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCC(C1)C(=O)NNC(=O)CC2=CNC3=CC=CC=C32

Isomeric SMILES

CC(C)(C)OC(=O)N1CCCC(C1)C(=O)NNC(=O)CC2=CNC3=CC=CC=C32

InChI

InChI=1S/C21H28N4O4/c1-21(2,3)29-20(28)25-10-6-7-14(13-25)19(27)24-23-18(26)11-15-12-22-17-9-5-4-8-16(15)17/h4-5,8-9,12,14,22H,6-7,10-11,13H2,1-3H3,(H,23,26)(H,24,27)