(phenylmethyl) 2-[[2-(1-azanylethyl)-1,3-oxazol-4-yl]carbonylamino]-3-phenyl-propanoate

Systemtic Name: (phenylmethyl) 2-[[2-(1-azanylethyl)-1,3-oxazol-4-yl]carbonylamino]-3-phenyl-propanoate Openeye Name: benzyl 2-[[2-(1-aminoethyl)oxazole-4-carbonyl]amino]-3-phenyl-propanoate CAS Name: 2-[[[2-(1-aminoethyl)-4-oxazolyl]-oxomethyl]amino]-3-phenylpropanoic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[[2-(1-aminoethyl)-1,3-oxazole-4-carbonyl]amino]-3-phenylpropanoate Traditional Name: 2-[[2-(1-aminoethyl)oxazole-4-carbonyl]amino]-3-phenyl-propionic acid benzyl ester Formula: C22H23N3O4 MolecularWeight: 393.43572

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC(=CO1)C(=O)NC(CC2=CC=CC=C2)C(=O)OCC3=CC=CC=C3)N

Isomeric SMILES

CC(C1=NC(=CO1)C(=O)NC(CC2=CC=CC=C2)C(=O)OCC3=CC=CC=C3)N

InChI

InChI=1S/C22H23N3O4/c1-15(23)21-25-19(14-28-21)20(26)24-18(12-16-8-4-2-5-9-16)22(27)29-13-17-10-6-3-7-11-17/h2-11,14-15,18H,12-13,23H2,1H3,(H,24,26)