(phenylmethyl) 4-[5-(2-phenylethanoylamino)pyridin-2-yl]piperazine-1-carboxylate

Systemtic Name: (phenylmethyl) 4-[5-(2-phenylethanoylamino)pyridin-2-yl]piperazine-1-carboxylate Openeye Name: benzyl 4-[5-[(2-phenylacetyl)amino]-2-pyridyl]piperazine-1-carboxylate CAS Name: 4-[5-[(1-oxo-2-phenylethyl)amino]-2-pyridinyl]-1-piperazinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-[5-[(2-phenylacetyl)amino]pyridin-2-yl]piperazine-1-carboxylate Traditional Name: 4-[5-[(2-phenylacetyl)amino]-2-pyridyl]piperazine-1-carboxylic acid benzyl ester Formula: C25H26N4O3 MolecularWeight: 430.49894

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=C(C=C2)NC(=O)CC3=CC=CC=C3)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C2=NC=C(C=C2)NC(=O)CC3=CC=CC=C3)C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C25H26N4O3/c30-24(17-20-7-3-1-4-8-20)27-22-11-12-23(26-18-22)28-13-15-29(16-14-28)25(31)32-19-21-9-5-2-6-10-21/h1-12,18H,13-17,19H2,(H,27,30)