ethyl 4-[2-[3-[(4-cyanophenyl)methyl]indolizin-1-yl]-2-oxidanylidene-ethanoyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[2-[3-[(4-cyanophenyl)methyl]indolizin-1-yl]-2-oxidanylidene-ethanoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[2-[3-[(4-cyanophenyl)methyl]indolizin-1-yl]-2-oxo-acetyl]piperazine-1-carboxylate CAS Name: 4-[2-[3-[(4-cyanophenyl)methyl]-1-indolizinyl]-1,2-dioxoethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-[3-[(4-cyanophenyl)methyl]indolizin-1-yl]-2-oxoacetyl]piperazine-1-carboxylate Traditional Name: 4-[2-[3-(4-cyanobenzyl)indolizin-1-yl]-2-keto-acetyl]piperazine-1-carboxylic acid ethyl ester Formula: C25H24N4O4 MolecularWeight: 444.48246

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C(=O)C2=C3C=CC=CN3C(=C2)CC4=CC=C(C=C4)C#N

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C(=O)C2=C3C=CC=CN3C(=C2)CC4=CC=C(C=C4)C#N

InChI

InChI=1S/C25H24N4O4/c1-2-33-25(32)28-13-11-27(12-14-28)24(31)23(30)21-16-20(29-10-4-3-5-22(21)29)15-18-6-8-19(17-26)9-7-18/h3-10,16H,2,11-15H2,1H3