2-[[(E)-3-(2-methoxy-5-methyl-phenyl)prop-2-enoyl]amino]-3-methyl-butanoic acid

Systemtic Name: 2-[[(E)-3-(2-methoxy-5-methyl-phenyl)prop-2-enoyl]amino]-3-methyl-butanoic acid Openeye Name: 2-[[(E)-3-(2-methoxy-5-methyl-phenyl)prop-2-enoyl]amino]-3-methyl-butanoic acid CAS Name: 2-[[(E)-3-(2-methoxy-5-methylphenyl)-1-oxoprop-2-enyl]amino]-3-methylbutanoic acid IUPAC Name: 2-[[(E)-3-(2-methoxy-5-methylphenyl)prop-2-enoyl]amino]-3-methylbutanoic acid Traditional Name: 2-[[(E)-3-(2-methoxy-5-methyl-phenyl)acryloyl]amino]-3-methyl-butyric acid Formula: C16H21NO4 MolecularWeight: 291.34224

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H21NO4/c1-10(2)15(16(19)20)17-14(18)8-6-12-9-11(3)5-7-13(12)21-4/h5-10,15H,1-4H3,(H,17,18)(H,19,20)/b8-6+