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

Systemtic Name: 2-[[(E)-3-(3,4-dimethylphenyl)prop-2-enoyl]amino]benzoic acid Openeye Name: 2-[[(E)-3-(3,4-dimethylphenyl)prop-2-enoyl]amino]benzoic acid CAS Name: 2-[[(E)-3-(3,4-dimethylphenyl)-1-oxoprop-2-enyl]amino]benzoic acid IUPAC Name: 2-[[(E)-3-(3,4-dimethylphenyl)prop-2-enoyl]amino]benzoic acid Traditional Name: 2-[[(E)-3-(3,4-dimethylphenyl)acryloyl]amino]benzoic acid Formula: C18H17NO3 MolecularWeight: 295.33248

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C=CC(=O)NC2=CC=CC=C2C(=O)O)C

Isomeric SMILES

CC1=C(C=C(C=C1)/C=C/C(=O)NC2=CC=CC=C2C(=O)O)C

InChI

InChI=1S/C18H17NO3/c1-12-7-8-14(11-13(12)2)9-10-17(20)19-16-6-4-3-5-15(16)18(21)22/h3-11H,1-2H3,(H,19,20)(H,21,22)/b10-9+