(4-nitrophenyl) 3-methyl-2-[[methyl(1-pyridin-2-ylethyl)carbamoyl]amino]butanoate

Systemtic Name: (4-nitrophenyl) 3-methyl-2-[[methyl(1-pyridin-2-ylethyl)carbamoyl]amino]butanoate Openeye Name: (4-nitrophenyl) 3-methyl-2-[[methyl-[1-(2-pyridyl)ethyl]carbamoyl]amino]butanoate CAS Name: 3-methyl-2-[[[methyl-[1-(2-pyridinyl)ethyl]amino]-oxomethyl]amino]butanoic acid (4-nitrophenyl) ester IUPAC Name: (4-nitrophenyl) 3-methyl-2-[[methyl(1-pyridin-2-ylethyl)carbamoyl]amino]butanoate Traditional Name: 3-methyl-2-[[methyl-[1-(2-pyridyl)ethyl]carbamoyl]amino]butyric acid (4-nitrophenyl) ester Formula: C20H24N4O5 MolecularWeight: 400.42836

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OC1=CC=C(C=C1)[N+](=O)[O-])NC(=O)N(C)C(C)C2=CC=CC=N2

Isomeric SMILES

CC(C)C(C(=O)OC1=CC=C(C=C1)[N+](=O)[O-])NC(=O)N(C)C(C)C2=CC=CC=N2

InChI

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