[4-(6-oxidanylidene-4,5-dihydro-1H-pyridazin-3-yl)phenyl]methyl (E)-3-azanylbut-2-enoate

Systemtic Name: [4-(6-oxidanylidene-4,5-dihydro-1H-pyridazin-3-yl)phenyl]methyl (E)-3-azanylbut-2-enoate Openeye Name: [4-(6-oxo-4,5-dihydro-1H-pyridazin-3-yl)phenyl]methyl (E)-3-aminobut-2-enoate CAS Name: (E)-3-amino-2-butenoic acid [4-(6-oxo-4,5-dihydro-1H-pyridazin-3-yl)phenyl]methyl ester IUPAC Name: [4-(6-oxo-4,5-dihydro-1H-pyridazin-3-yl)phenyl]methyl (E)-3-aminobut-2-enoate Traditional Name: (E)-3-aminobut-2-enoic acid [4-(6-keto-4,5-dihydro-1H-pyridazin-3-yl)benzyl] ester Formula: C15H17N3O3 MolecularWeight: 287.31378

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)OCC1=CC=C(C=C1)C2=NNC(=O)CC2)N

Isomeric SMILES

C/C(=C\C(=O)OCC1=CC=C(C=C1)C2=NNC(=O)CC2)/N

InChI

InChI=1S/C15H17N3O3/c1-10(16)8-15(20)21-9-11-2-4-12(5-3-11)13-6-7-14(19)18-17-13/h2-5,8H,6-7,9,16H2,1H3,(H,18,19)/b10-8+