ethyl 4-(6-ethoxycarbonylpyridazin-3-yl)-2-[(4-fluorophenyl)methyl]-5-oxidanylidene-7,8,9,9a-tetrahydropyrido[2,3-a]pyrrolizine-3-carboxylate

Systemtic Name: ethyl 4-(6-ethoxycarbonylpyridazin-3-yl)-2-[(4-fluorophenyl)methyl]-5-oxidanylidene-7,8,9,9a-tetrahydropyrido[2,3-a]pyrrolizine-3-carboxylate Openeye Name: ethyl 4-(6-ethoxycarbonylpyridazin-3-yl)-2-[(4-fluorophenyl)methyl]-5-oxo-7,8,9,9a-tetrahydropyrido[2,3-a]pyrrolizine-3-carboxylate CAS Name: 4-(6-ethoxycarbonyl-3-pyridazinyl)-2-[(4-fluorophenyl)methyl]-5-oxo-7,8,9,9a-tetrahydropyrido[2,3-a]pyrrolizine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 4-(6-ethoxycarbonylpyridazin-3-yl)-2-[(4-fluorophenyl)methyl]-5-oxo-7,8,9,9a-tetrahydropyrido[2,3-a]pyrrolizine-3-carboxylate Traditional Name: 4-(6-carbethoxypyridazin-3-yl)-2-(4-fluorobenzyl)-5-keto-7,8,9,9a-tetrahydropyrido[2,3-a]pyrrolizine-3-carboxylic acid ethyl ester Formula: C27H25FN4O5 MolecularWeight: 504.509603

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN=C(C=C1)C2=C3C(=NC(=C2C(=O)OCC)CC4=CC=C(C=C4)F)C5CCCN5C3=O

Isomeric SMILES

CCOC(=O)C1=NN=C(C=C1)C2=C3C(=NC(=C2C(=O)OCC)CC4=CC=C(C=C4)F)C5CCCN5C3=O

InChI

InChI=1S/C27H25FN4O5/c1-3-36-26(34)18-12-11-17(30-31-18)21-22(27(35)37-4-2)19(14-15-7-9-16(28)10-8-15)29-24-20-6-5-13-32(20)25(33)23(21)24/h7-12,20H,3-6,13-14H2,1-2H3