(E)-3-(3,4-diethoxyphenyl)-2-[(2-methylphenyl)carbonylamino]prop-2-enoic acid

Systemtic Name: (E)-3-(3,4-diethoxyphenyl)-2-[(2-methylphenyl)carbonylamino]prop-2-enoic acid Openeye Name: (E)-3-(3,4-diethoxyphenyl)-2-[(2-methylbenzoyl)amino]prop-2-enoic acid CAS Name: (E)-3-(3,4-diethoxyphenyl)-2-[[(2-methylphenyl)-oxomethyl]amino]-2-propenoic acid IUPAC Name: (E)-3-(3,4-diethoxyphenyl)-2-[(2-methylbenzoyl)amino]prop-2-enoic acid Traditional Name: (E)-3-(3,4-diethoxyphenyl)-2-(o-toluoylamino)acrylic acid Formula: C21H23NO5 MolecularWeight: 369.41102

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C=C(C(=O)O)NC(=O)C2=CC=CC=C2C)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)/C=C(\C(=O)O)/NC(=O)C2=CC=CC=C2C)OCC

InChI

InChI=1S/C21H23NO5/c1-4-26-18-11-10-15(13-19(18)27-5-2)12-17(21(24)25)22-20(23)16-9-7-6-8-14(16)3/h6-13H,4-5H2,1-3H3,(H,22,23)(H,24,25)/b17-12+