(Z)-2-(1-cyanoethyl)-3-propan-2-yl-but-2-enedioate

Systemtic Name: (Z)-2-(1-cyanoethyl)-3-propan-2-yl-but-2-enedioate Openeye Name: (Z)-2-(1-cyanoethyl)-3-isopropyl-but-2-enedioate CAS Name: (Z)-2-(1-cyanoethyl)-3-propan-2-yl-2-butenedioate IUPAC Name: (Z)-2-(1-cyanoethyl)-3-propan-2-ylbut-2-enedioate Traditional Name: (Z)-2-(1-cyanoethyl)-3-isopropyl-but-2-enedioate Formula: C10H11NO4-2 MolecularWeight: 209.19864

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=C(C(C)C#N)C(=O)[O-])C(=O)[O-]

Isomeric SMILES

CC(C)/C(=C(\C(C)C#N)/C(=O)[O-])/C(=O)[O-]

InChI

InChI=1S/C10H13NO4/c1-5(2)7(9(12)13)8(10(14)15)6(3)4-11/h5-6H,1-3H3,(H,12,13)(H,14,15)/p-2/b8-7-