ethyl 3-[(2-methylpropan-2-yl)oxycarbonylamino]-2-[(1-pyridin-4-ylpiperidin-4-yl)methylamino]propanoate

Systemtic Name: ethyl 3-[(2-methylpropan-2-yl)oxycarbonylamino]-2-[(1-pyridin-4-ylpiperidin-4-yl)methylamino]propanoate Openeye Name: ethyl 3-(tert-butoxycarbonylamino)-2-[[1-(4-pyridyl)-4-piperidyl]methylamino]propanoate CAS Name: 3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-2-[(1-pyridin-4-yl-4-piperidinyl)methylamino]propanoic acid ethyl ester IUPAC Name: ethyl 3-[(2-methylpropan-2-yl)oxycarbonylamino]-2-[(1-pyridin-4-ylpiperidin-4-yl)methylamino]propanoate Traditional Name: 3-(tert-butoxycarbonylamino)-2-[[1-(4-pyridyl)-4-piperidyl]methylamino]propionic acid ethyl ester Formula: C21H34N4O4 MolecularWeight: 406.51906

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CNC(=O)OC(C)(C)C)NCC1CCN(CC1)C2=CC=NC=C2

Isomeric SMILES

CCOC(=O)C(CNC(=O)OC(C)(C)C)NCC1CCN(CC1)C2=CC=NC=C2

InChI

InChI=1S/C21H34N4O4/c1-5-28-19(26)18(15-24-20(27)29-21(2,3)4)23-14-16-8-12-25(13-9-16)17-6-10-22-11-7-17/h6-7,10-11,16,18,23H,5,8-9,12-15H2,1-4H3,(H,24,27)