tert-butyl 4-[5-(prop-2-enoxycarbonylamino)-1H-pyrrolo[3,2-b]pyridin-3-yl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[5-(prop-2-enoxycarbonylamino)-1H-pyrrolo[3,2-b]pyridin-3-yl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[5-(allyloxycarbonylamino)-1H-pyrrolo[3,2-b]pyridin-3-yl]piperidine-1-carboxylate CAS Name: 4-[5-[[oxo(prop-2-enoxy)methyl]amino]-1H-pyrrolo[3,2-b]pyridin-3-yl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[5-(prop-2-enoxycarbonylamino)-1H-pyrrolo[3,2-b]pyridin-3-yl]piperidine-1-carboxylate Traditional Name: 4-[5-(allyloxycarbonylamino)-1H-pyrrolo[3,2-b]pyridin-3-yl]piperidine-1-carboxylic acid tert-butyl ester Formula: C21H28N4O4 MolecularWeight: 400.47142

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)C2=CNC3=C2N=C(C=C3)NC(=O)OCC=C

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)C2=CNC3=C2N=C(C=C3)NC(=O)OCC=C

InChI

InChI=1S/C21H28N4O4/c1-5-12-28-19(26)24-17-7-6-16-18(23-17)15(13-22-16)14-8-10-25(11-9-14)20(27)29-21(2,3)4/h5-7,13-14,22H,1,8-12H2,2-4H3,(H,23,24,26)