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

Systemtic Name: methyl (E)-2-cyano-3-[2-[2-(3-methylbutoxy)-2-oxidanylidene-ethyl]-3-oxidanylidene-piperazin-1-yl]prop-2-enoate Openeye Name: methyl (E)-2-cyano-3-[2-(2-isopentyloxy-2-oxo-ethyl)-3-oxo-piperazin-1-yl]prop-2-enoate CAS Name: (E)-2-cyano-3-[2-[2-(3-methylbutoxy)-2-oxoethyl]-3-oxo-1-piperazinyl]-2-propenoic acid methyl ester IUPAC Name: methyl (E)-2-cyano-3-[2-[2-(3-methylbutoxy)-2-oxoethyl]-3-oxopiperazin-1-yl]prop-2-enoate Traditional Name: (E)-2-cyano-3-[2-(2-isoamoxy-2-keto-ethyl)-3-keto-piperazino]acrylic acid methyl ester Formula: C16H23N3O5 MolecularWeight: 337.37092

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC(=O)CC1C(=O)NCCN1C=C(C#N)C(=O)OC

Isomeric SMILES

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

InChI

InChI=1S/C16H23N3O5/c1-11(2)4-7-24-14(20)8-13-15(21)18-5-6-19(13)10-12(9-17)16(22)23-3/h10-11,13H,4-8H2,1-3H3,(H,18,21)/b12-10+