ethyl 2-(phenylmethoxycarbonylamino)-3-[(1-pyridin-4-ylpiperidin-4-yl)carbonylamino]propanoate

Systemtic Name: ethyl 2-(phenylmethoxycarbonylamino)-3-[(1-pyridin-4-ylpiperidin-4-yl)carbonylamino]propanoate Openeye Name: ethyl 2-(benzyloxycarbonylamino)-3-[[1-(4-pyridyl)piperidine-4-carbonyl]amino]propanoate CAS Name: 3-[[oxo-(1-pyridin-4-yl-4-piperidinyl)methyl]amino]-2-(phenylmethoxycarbonylamino)propanoic acid ethyl ester IUPAC Name: ethyl 2-(phenylmethoxycarbonylamino)-3-[(1-pyridin-4-ylpiperidine-4-carbonyl)amino]propanoate Traditional Name: 2-(benzyloxycarbonylamino)-3-[[1-(4-pyridyl)isonipecotoyl]amino]propionic acid ethyl ester Formula: C24H30N4O5 MolecularWeight: 454.5188

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CNC(=O)C1CCN(CC1)C2=CC=NC=C2)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C(CNC(=O)C1CCN(CC1)C2=CC=NC=C2)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C24H30N4O5/c1-2-32-23(30)21(27-24(31)33-17-18-6-4-3-5-7-18)16-26-22(29)19-10-14-28(15-11-19)20-8-12-25-13-9-20/h3-9,12-13,19,21H,2,10-11,14-17H2,1H3,(H,26,29)(H,27,31)