ethyl 2-[(E)-C-methyl-N-(phenylcarbamoylamino)carbonimidoyl]-3-(4-nitrophenyl)-4-oxidanylidene-pentanoate

Systemtic Name: ethyl 2-[(E)-C-methyl-N-(phenylcarbamoylamino)carbonimidoyl]-3-(4-nitrophenyl)-4-oxidanylidene-pentanoate Openeye Name: ethyl 2-[(E)-C-methyl-N-(phenylcarbamoylamino)carbonimidoyl]-3-(4-nitrophenyl)-4-oxo-pentanoate CAS Name: 2-[(1E)-1-[[anilino(oxo)methyl]hydrazinylidene]ethyl]-3-(4-nitrophenyl)-4-oxopentanoic acid ethyl ester IUPAC Name: ethyl 2-[(E)-C-methyl-N-(phenylcarbamoylamino)carbonimidoyl]-3-(4-nitrophenyl)-4-oxopentanoate Traditional Name: 4-keto-2-[(E)-C-methyl-N-(phenylcarbamoylamino)carbonimidoyl]-3-(4-nitrophenyl)valeric acid ethyl ester Formula: C22H24N4O6 MolecularWeight: 440.44916

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(C1=CC=C(C=C1)[N+](=O)[O-])C(=O)C)C(=NNC(=O)NC2=CC=CC=C2)C

Isomeric SMILES

CCOC(=O)C(C(C1=CC=C(C=C1)[N+](=O)[O-])C(=O)C)/C(=N/NC(=O)NC2=CC=CC=C2)/C

InChI

InChI=1S/C22H24N4O6/c1-4-32-21(28)19(14(2)24-25-22(29)23-17-8-6-5-7-9-17)20(15(3)27)16-10-12-18(13-11-16)26(30)31/h5-13,19-20H,4H2,1-3H3,(H2,23,25,29)/b24-14+