(E)-2-acetamido-3-(2,6-diethyl-4-methoxy-phenyl)prop-2-enoic acid

Systemtic Name: (E)-2-acetamido-3-(2,6-diethyl-4-methoxy-phenyl)prop-2-enoic acid Openeye Name: (E)-2-acetamido-3-(2,6-diethyl-4-methoxy-phenyl)prop-2-enoic acid CAS Name: (E)-2-acetamido-3-(2,6-diethyl-4-methoxyphenyl)-2-propenoic acid IUPAC Name: (E)-2-acetamido-3-(2,6-diethyl-4-methoxyphenyl)prop-2-enoic acid Traditional Name: (E)-2-acetamido-3-(2,6-diethyl-4-methoxy-phenyl)acrylic acid Formula: C16H21NO4 MolecularWeight: 291.34224

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC(=C1C=C(C(=O)O)NC(=O)C)CC)OC

Isomeric SMILES

CCC1=CC(=CC(=C1/C=C(\C(=O)O)/NC(=O)C)CC)OC

InChI

InChI=1S/C16H21NO4/c1-5-11-7-13(21-4)8-12(6-2)14(11)9-15(16(19)20)17-10(3)18/h7-9H,5-6H2,1-4H3,(H,17,18)(H,19,20)/b15-9+