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

Systemtic Name: 4-[[4-(6-oxidanylidene-4,5-dihydro-1H-pyridazin-3-yl)phenyl]amino]butyl (E)-3-azanylbut-2-enoate Openeye Name: 4-[4-(6-oxo-4,5-dihydro-1H-pyridazin-3-yl)anilino]butyl (E)-3-aminobut-2-enoate CAS Name: (E)-3-amino-2-butenoic acid 4-[4-(6-oxo-4,5-dihydro-1H-pyridazin-3-yl)anilino]butyl ester IUPAC Name: 4-[4-(6-oxo-4,5-dihydro-1H-pyridazin-3-yl)anilino]butyl (E)-3-aminobut-2-enoate Traditional Name: (E)-3-aminobut-2-enoic acid 4-[4-(6-keto-4,5-dihydro-1H-pyridazin-3-yl)anilino]butyl ester Formula: C18H24N4O3 MolecularWeight: 344.40816

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)OCCCCNC1=CC=C(C=C1)C2=NNC(=O)CC2)N

Isomeric SMILES

C/C(=C\C(=O)OCCCCNC1=CC=C(C=C1)C2=NNC(=O)CC2)/N

InChI

InChI=1S/C18H24N4O3/c1-13(19)12-18(24)25-11-3-2-10-20-15-6-4-14(5-7-15)16-8-9-17(23)22-21-16/h4-7,12,20H,2-3,8-11,19H2,1H3,(H,22,23)/b13-12+