[2-[[(2R)-butan-2-yl]carbamoylamino]-2-oxidanylidene-ethyl] (E)-2-cyano-3-(4-propan-2-ylphenyl)prop-2-enoate

Systemtic Name: [2-[[(2R)-butan-2-yl]carbamoylamino]-2-oxidanylidene-ethyl] (E)-2-cyano-3-(4-propan-2-ylphenyl)prop-2-enoate Openeye Name: [2-[[(1R)-1-methylpropyl]carbamoylamino]-2-oxo-ethyl] (E)-2-cyano-3-(4-isopropylphenyl)prop-2-enoate CAS Name: (E)-2-cyano-3-(4-propan-2-ylphenyl)-2-propenoic acid [2-[[[[(2R)-butan-2-yl]amino]-oxomethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-[[(2R)-butan-2-yl]carbamoylamino]-2-oxoethyl] (E)-2-cyano-3-(4-propan-2-ylphenyl)prop-2-enoate Traditional Name: (E)-2-cyano-3-p-cumenyl-acrylic acid [2-keto-2-[[(1R)-1-methylpropyl]carbamoylamino]ethyl] ester Formula: C20H25N3O4 MolecularWeight: 371.4302

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)NC(=O)COC(=O)C(=CC1=CC=C(C=C1)C(C)C)C#N

Isomeric SMILES

CC[C@@H](C)NC(=O)NC(=O)COC(=O)/C(=C/C1=CC=C(C=C1)C(C)C)/C#N

InChI

InChI=1S/C20H25N3O4/c1-5-14(4)22-20(26)23-18(24)12-27-19(25)17(11-21)10-15-6-8-16(9-7-15)13(2)3/h6-10,13-14H,5,12H2,1-4H3,(H2,22,23,24,26)/b17-10+/t14-/m1/s1