methyl (E)-6-acetyloxy-2-[[4-[(E)-hydroxyiminomethyl]phenyl]carbamoylamino]hex-4-enoate

Systemtic Name: methyl (E)-6-acetyloxy-2-[[4-[(E)-hydroxyiminomethyl]phenyl]carbamoylamino]hex-4-enoate Openeye Name: methyl (E)-6-acetoxy-2-[[4-[(E)-hydroxyiminomethyl]phenyl]carbamoylamino]hex-4-enoate CAS Name: (E)-6-acetyloxy-2-[[[4-[(E)-hydroxyiminomethyl]anilino]-oxomethyl]amino]-4-hexenoic acid methyl ester IUPAC Name: methyl (E)-6-acetyloxy-2-[[4-[(E)-hydroxyiminomethyl]phenyl]carbamoylamino]hex-4-enoate Traditional Name: (E)-6-acetoxy-2-[[4-[(E)-hydroximinomethyl]phenyl]carbamoylamino]hex-4-enoic acid methyl ester Formula: C17H21N3O6 MolecularWeight: 363.36514

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC=CCC(C(=O)OC)NC(=O)NC1=CC=C(C=C1)C=NO

Isomeric SMILES

CC(=O)OC/C=C/CC(C(=O)OC)NC(=O)NC1=CC=C(C=C1)/C=N/O

InChI

InChI=1S/C17H21N3O6/c1-12(21)26-10-4-3-5-15(16(22)25-2)20-17(23)19-14-8-6-13(7-9-14)11-18-24/h3-4,6-9,11,15,24H,5,10H2,1-2H3,(H2,19,20,23)/b4-3+,18-11+