(4-nitrophenyl) 2-[[ethyl(pyridin-2-ylmethyl)carbamoyl]amino]-3-methyl-butanoate

Systemtic Name: (4-nitrophenyl) 2-[[ethyl(pyridin-2-ylmethyl)carbamoyl]amino]-3-methyl-butanoate Openeye Name: (4-nitrophenyl) 2-[[ethyl(2-pyridylmethyl)carbamoyl]amino]-3-methyl-butanoate CAS Name: 2-[[[ethyl(2-pyridinylmethyl)amino]-oxomethyl]amino]-3-methylbutanoic acid (4-nitrophenyl) ester IUPAC Name: (4-nitrophenyl) 2-[[ethyl(pyridin-2-ylmethyl)carbamoyl]amino]-3-methylbutanoate Traditional Name: 2-[[ethyl(2-pyridylmethyl)carbamoyl]amino]-3-methyl-butyric acid (4-nitrophenyl) ester Formula: C20H24N4O5 MolecularWeight: 400.42836

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=CC=N1)C(=O)NC(C(C)C)C(=O)OC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCN(CC1=CC=CC=N1)C(=O)NC(C(C)C)C(=O)OC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C20H24N4O5/c1-4-23(13-15-7-5-6-12-21-15)20(26)22-18(14(2)3)19(25)29-17-10-8-16(9-11-17)24(27)28/h5-12,14,18H,4,13H2,1-3H3,(H,22,26)