methyl 3-oxidanylidene-3-[[4-(5-oxidanylidene-3,4-diazabicyclo[4.1.0]hept-2-en-2-yl)phenyl]amino]propanoate

Systemtic Name: methyl 3-oxidanylidene-3-[[4-(5-oxidanylidene-3,4-diazabicyclo[4.1.0]hept-2-en-2-yl)phenyl]amino]propanoate Openeye Name: methyl 3-oxo-3-[4-(5-oxo-3,4-diazabicyclo[4.1.0]hept-2-en-2-yl)anilino]propanoate CAS Name: 3-oxo-3-[4-(5-oxo-3,4-diazabicyclo[4.1.0]hept-2-en-2-yl)anilino]propanoic acid methyl ester IUPAC Name: methyl 3-oxo-3-[4-(5-oxo-3,4-diazabicyclo[4.1.0]hept-2-en-2-yl)anilino]propanoate Traditional Name: 3-keto-3-[4-(5-keto-3,4-diazabicyclo[4.1.0]hept-2-en-2-yl)anilino]propionic acid methyl ester Formula: C15H15N3O4 MolecularWeight: 301.2973

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(=O)NC1=CC=C(C=C1)C2=NNC(=O)C3C2C3

Isomeric SMILES

COC(=O)CC(=O)NC1=CC=C(C=C1)C2=NNC(=O)C3C2C3

InChI

InChI=1S/C15H15N3O4/c1-22-13(20)7-12(19)16-9-4-2-8(3-5-9)14-10-6-11(10)15(21)18-17-14/h2-5,10-11H,6-7H2,1H3,(H,16,19)(H,18,21)