(phenylmethyl) 3-[2-(3-nitrophenyl)ethanoylamino]propanoate

Systemtic Name: (phenylmethyl) 3-[2-(3-nitrophenyl)ethanoylamino]propanoate Openeye Name: benzyl 3-[[2-(3-nitrophenyl)acetyl]amino]propanoate CAS Name: 3-[[2-(3-nitrophenyl)-1-oxoethyl]amino]propanoic acid (phenylmethyl) ester IUPAC Name: benzyl 3-[[2-(3-nitrophenyl)acetyl]amino]propanoate Traditional Name: 3-[[2-(3-nitrophenyl)acetyl]amino]propionic acid benzyl ester Formula: C18H18N2O5 MolecularWeight: 342.34592

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)CCNC(=O)CC2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)CCNC(=O)CC2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C18H18N2O5/c21-17(12-15-7-4-8-16(11-15)20(23)24)19-10-9-18(22)25-13-14-5-2-1-3-6-14/h1-8,11H,9-10,12-13H2,(H,19,21)