[2-oxidanylidene-2-(2,4,4-trimethylpentan-2-ylamino)ethyl] (E)-3-(3-methylphenyl)prop-2-enoate

Systemtic Name: [2-oxidanylidene-2-(2,4,4-trimethylpentan-2-ylamino)ethyl] (E)-3-(3-methylphenyl)prop-2-enoate Openeye Name: [2-oxo-2-(1,1,3,3-tetramethylbutylamino)ethyl] (E)-3-(m-tolyl)prop-2-enoate CAS Name: (E)-3-(3-methylphenyl)-2-propenoic acid [2-oxo-2-(2,4,4-trimethylpentan-2-ylamino)ethyl] ester IUPAC Name: [2-oxo-2-(2,4,4-trimethylpentan-2-ylamino)ethyl] (E)-3-(3-methylphenyl)prop-2-enoate Traditional Name: (E)-3-(m-tolyl)acrylic acid [2-keto-2-(1,1,3,3-tetramethylbutylamino)ethyl] ester Formula: C20H29NO3 MolecularWeight: 331.44916

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C=CC(=O)OCC(=O)NC(C)(C)CC(C)(C)C

Isomeric SMILES

CC1=CC=CC(=C1)/C=C/C(=O)OCC(=O)NC(C)(C)CC(C)(C)C

InChI

InChI=1S/C20H29NO3/c1-15-8-7-9-16(12-15)10-11-18(23)24-13-17(22)21-20(5,6)14-19(2,3)4/h7-12H,13-14H2,1-6H3,(H,21,22)/b11-10+