3-[[3-[5-(3-chlorophenyl)furan-2-yl]-2-cyano-prop-2-enoyl]amino]benzoic acid

Systemtic Name: 3-[[3-[5-(3-chlorophenyl)furan-2-yl]-2-cyano-prop-2-enoyl]amino]benzoic acid Openeye Name: 3-[[3-[5-(3-chlorophenyl)-2-furyl]-2-cyano-prop-2-enoyl]amino]benzoic acid CAS Name: 3-[[3-[5-(3-chlorophenyl)-2-furanyl]-2-cyano-1-oxoprop-2-enyl]amino]benzoic acid IUPAC Name: 3-[[3-[5-(3-chlorophenyl)furan-2-yl]-2-cyanoprop-2-enoyl]amino]benzoic acid Traditional Name: 3-[[3-[5-(3-chlorophenyl)-2-furyl]-2-cyano-acryloyl]amino]benzoic acid Formula: C21H13ClN2O4 MolecularWeight: 392.79192

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)C2=CC=C(O2)C=C(C#N)C(=O)NC3=CC=CC(=C3)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)Cl)C2=CC=C(O2)C=C(C#N)C(=O)NC3=CC=CC(=C3)C(=O)O

InChI

InChI=1S/C21H13ClN2O4/c22-16-5-1-3-13(9-16)19-8-7-18(28-19)11-15(12-23)20(25)24-17-6-2-4-14(10-17)21(26)27/h1-11H,(H,24,25)(H,26,27)