3-[(2-methylpropan-2-yl)oxycarbonylamino]propyl 4-(1H-indol-4-yl)piperazine-1-carboxylate

Systemtic Name: 3-[(2-methylpropan-2-yl)oxycarbonylamino]propyl 4-(1H-indol-4-yl)piperazine-1-carboxylate Openeye Name: 3-(tert-butoxycarbonylamino)propyl 4-(1H-indol-4-yl)piperazine-1-carboxylate CAS Name: 4-(1H-indol-4-yl)-1-piperazinecarboxylic acid 3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propyl ester IUPAC Name: 3-[(2-methylpropan-2-yl)oxycarbonylamino]propyl 4-(1H-indol-4-yl)piperazine-1-carboxylate Traditional Name: 4-(1H-indol-4-yl)piperazine-1-carboxylic acid 3-(tert-butoxycarbonylamino)propyl ester Formula: C21H30N4O4 MolecularWeight: 402.4873

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCCOC(=O)N1CCN(CC1)C2=CC=CC3=C2C=CN3

Isomeric SMILES

CC(C)(C)OC(=O)NCCCOC(=O)N1CCN(CC1)C2=CC=CC3=C2C=CN3

InChI

InChI=1S/C21H30N4O4/c1-21(2,3)29-19(26)23-9-5-15-28-20(27)25-13-11-24(12-14-25)18-7-4-6-17-16(18)8-10-22-17/h4,6-8,10,22H,5,9,11-15H2,1-3H3,(H,23,26)