ethyl 4-[[4-[4-(2-ethylbutanoyl)piperazin-1-yl]phenyl]amino]-4-oxidanylidene-butanoate

Systemtic Name: ethyl 4-[[4-[4-(2-ethylbutanoyl)piperazin-1-yl]phenyl]amino]-4-oxidanylidene-butanoate Openeye Name: ethyl 4-[4-[4-(2-ethylbutanoyl)piperazin-1-yl]anilino]-4-oxo-butanoate CAS Name: 4-[4-[4-(2-ethyl-1-oxobutyl)-1-piperazinyl]anilino]-4-oxobutanoic acid ethyl ester IUPAC Name: ethyl 4-[4-[4-(2-ethylbutanoyl)piperazin-1-yl]anilino]-4-oxobutanoate Traditional Name: 4-[4-[4-(2-ethylbutanoyl)piperazino]anilino]-4-keto-butyric acid ethyl ester Formula: C22H33N3O4 MolecularWeight: 403.51512

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C(=O)N1CCN(CC1)C2=CC=C(C=C2)NC(=O)CCC(=O)OCC

Isomeric SMILES

CCC(CC)C(=O)N1CCN(CC1)C2=CC=C(C=C2)NC(=O)CCC(=O)OCC

InChI

InChI=1S/C22H33N3O4/c1-4-17(5-2)22(28)25-15-13-24(14-16-25)19-9-7-18(8-10-19)23-20(26)11-12-21(27)29-6-3/h7-10,17H,4-6,11-16H2,1-3H3,(H,23,26)