(phenylmethyl) 2-[[1-(2-pyridin-2-ylethyl)aziridin-2-yl]carbonylamino]propanoate

Systemtic Name: (phenylmethyl) 2-[[1-(2-pyridin-2-ylethyl)aziridin-2-yl]carbonylamino]propanoate Openeye Name: benzyl 2-[[1-[2-(2-pyridyl)ethyl]aziridine-2-carbonyl]amino]propanoate CAS Name: 2-[[oxo-[1-[2-(2-pyridinyl)ethyl]-2-aziridinyl]methyl]amino]propanoic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[[1-(2-pyridin-2-ylethyl)aziridine-2-carbonyl]amino]propanoate Traditional Name: 2-[[1-[2-(2-pyridyl)ethyl]ethylenimine-2-carbonyl]amino]propionic acid benzyl ester Formula: C20H23N3O3 MolecularWeight: 353.41492

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCC1=CC=CC=C1)NC(=O)C2CN2CCC3=CC=CC=N3

Isomeric SMILES

CC(C(=O)OCC1=CC=CC=C1)NC(=O)C2CN2CCC3=CC=CC=N3

InChI

InChI=1S/C20H23N3O3/c1-15(20(25)26-14-16-7-3-2-4-8-16)22-19(24)18-13-23(18)12-10-17-9-5-6-11-21-17/h2-9,11,15,18H,10,12-14H2,1H3,(H,22,24)