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

Systemtic Name: methyl (E)-3-[2-(2-butan-2-yloxy-2-oxidanylidene-ethyl)-3-oxidanylidene-piperazin-1-yl]-2-cyano-prop-2-enoate Openeye Name: methyl (E)-2-cyano-3-[3-oxo-2-(2-oxo-2-sec-butoxy-ethyl)piperazin-1-yl]prop-2-enoate CAS Name: (E)-3-[2-(2-butan-2-yloxy-2-oxoethyl)-3-oxo-1-piperazinyl]-2-cyano-2-propenoic acid methyl ester IUPAC Name: methyl (E)-3-[2-(2-butan-2-yloxy-2-oxoethyl)-3-oxopiperazin-1-yl]-2-cyanoprop-2-enoate Traditional Name: (E)-2-cyano-3-[3-keto-2-(2-keto-2-sec-butoxy-ethyl)piperazino]acrylic acid methyl ester Formula: C15H21N3O5 MolecularWeight: 323.34434

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H21N3O5/c1-4-10(2)23-13(19)7-12-14(20)17-5-6-18(12)9-11(8-16)15(21)22-3/h9-10,12H,4-7H2,1-3H3,(H,17,20)/b11-9+