butyl (E)-4-[4-[(E)-4-butoxy-4-oxidanylidene-but-2-enoyl]-2,5-dimethyl-piperazin-1-yl]-4-oxidanylidene-but-2-enoate

Systemtic Name: butyl (E)-4-[4-[(E)-4-butoxy-4-oxidanylidene-but-2-enoyl]-2,5-dimethyl-piperazin-1-yl]-4-oxidanylidene-but-2-enoate Openeye Name: butyl (E)-4-[4-[(E)-4-butoxy-4-oxo-but-2-enoyl]-2,5-dimethyl-piperazin-1-yl]-4-oxo-but-2-enoate CAS Name: (E)-4-[4-[(E)-4-butoxy-1,4-dioxobut-2-enyl]-2,5-dimethyl-1-piperazinyl]-4-oxo-2-butenoic acid butyl ester IUPAC Name: butyl (E)-4-[4-[(E)-4-butoxy-4-oxobut-2-enoyl]-2,5-dimethylpiperazin-1-yl]-4-oxobut-2-enoate Traditional Name: (E)-4-[4-[(E)-4-butoxy-4-keto-but-2-enoyl]-2,5-dimethyl-piperazino]-4-keto-but-2-enoic acid butyl ester Formula: C22H34N2O6 MolecularWeight: 422.51516

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C=CC(=O)N1CC(N(CC1C)C(=O)C=CC(=O)OCCCC)C

Isomeric SMILES

CCCCOC(=O)/C=C/C(=O)N1C(CN(C(C1)C)C(=O)/C=C/C(=O)OCCCC)C

InChI

InChI=1S/C22H34N2O6/c1-5-7-13-29-21(27)11-9-19(25)23-15-18(4)24(16-17(23)3)20(26)10-12-22(28)30-14-8-6-2/h9-12,17-18H,5-8,13-16H2,1-4H3/b11-9+,12-10+