(phenylmethyl) 2-[[2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-pyridin-2-yl-propanoyl]amino]ethanoate

Systemtic Name: (phenylmethyl) 2-[[2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-pyridin-2-yl-propanoyl]amino]ethanoate Openeye Name: benzyl 2-[[2-(tert-butoxycarbonylamino)-3-(2-pyridyl)propanoyl]amino]acetate CAS Name: 2-[[2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxo-3-(2-pyridinyl)propyl]amino]acetic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[[2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-pyridin-2-ylpropanoyl]amino]acetate Traditional Name: 2-[[2-(tert-butoxycarbonylamino)-3-(2-pyridyl)propanoyl]amino]acetic acid benzyl ester Formula: C22H27N3O5 MolecularWeight: 413.46688

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CC=CC=N1)C(=O)NCC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)NC(CC1=CC=CC=N1)C(=O)NCC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C22H27N3O5/c1-22(2,3)30-21(28)25-18(13-17-11-7-8-12-23-17)20(27)24-14-19(26)29-15-16-9-5-4-6-10-16/h4-12,18H,13-15H2,1-3H3,(H,24,27)(H,25,28)