2-[[(E)-3-(2,4-dimethylphenyl)prop-2-enoyl]amino]-3,3-dimethyl-butanoic acid

Systemtic Name: 2-[[(E)-3-(2,4-dimethylphenyl)prop-2-enoyl]amino]-3,3-dimethyl-butanoic acid Openeye Name: 2-[[(E)-3-(2,4-dimethylphenyl)prop-2-enoyl]amino]-3,3-dimethyl-butanoic acid CAS Name: 2-[[(E)-3-(2,4-dimethylphenyl)-1-oxoprop-2-enyl]amino]-3,3-dimethylbutanoic acid IUPAC Name: 2-[[(E)-3-(2,4-dimethylphenyl)prop-2-enoyl]amino]-3,3-dimethylbutanoic acid Traditional Name: 2-[[(E)-3-(2,4-dimethylphenyl)acryloyl]amino]-3,3-dimethyl-butyric acid Formula: C17H23NO3 MolecularWeight: 289.36942

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H23NO3/c1-11-6-7-13(12(2)10-11)8-9-14(19)18-15(16(20)21)17(3,4)5/h6-10,15H,1-5H3,(H,18,19)(H,20,21)/b9-8+