methyl (E)-2-cyano-3-[2-(2-decoxy-2-oxidanylidene-ethyl)-3-oxidanylidene-piperazin-1-yl]prop-2-enoate

Systemtic Name: methyl (E)-2-cyano-3-[2-(2-decoxy-2-oxidanylidene-ethyl)-3-oxidanylidene-piperazin-1-yl]prop-2-enoate Openeye Name: methyl (E)-2-cyano-3-[2-(2-decoxy-2-oxo-ethyl)-3-oxo-piperazin-1-yl]prop-2-enoate CAS Name: (E)-2-cyano-3-[2-(2-decoxy-2-oxoethyl)-3-oxo-1-piperazinyl]-2-propenoic acid methyl ester IUPAC Name: methyl (E)-2-cyano-3-[2-(2-decoxy-2-oxoethyl)-3-oxopiperazin-1-yl]prop-2-enoate Traditional Name: (E)-2-cyano-3-[2-(2-decoxy-2-keto-ethyl)-3-keto-piperazino]acrylic acid methyl ester Formula: C21H33N3O5 MolecularWeight: 407.50382

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC(=O)CC1C(=O)NCCN1C=C(C#N)C(=O)OC

Isomeric SMILES

CCCCCCCCCCOC(=O)CC1C(=O)NCCN1/C=C(\C#N)/C(=O)OC

InChI

InChI=1S/C21H33N3O5/c1-3-4-5-6-7-8-9-10-13-29-19(25)14-18-20(26)23-11-12-24(18)16-17(15-22)21(27)28-2/h16,18H,3-14H2,1-2H3,(H,23,26)/b17-16+