2-[2-[(4-ethanimidoylphenyl)carbamoyl]-4-(furan-2-yl)phenyl]-5-ethanoyl-benzoic acid

Systemtic Name: 2-[2-[(4-ethanimidoylphenyl)carbamoyl]-4-(furan-2-yl)phenyl]-5-ethanoyl-benzoic acid Openeye Name: 5-acetyl-2-[2-[(4-ethanimidoylphenyl)carbamoyl]-4-(2-furyl)phenyl]benzoic acid CAS Name: 5-acetyl-2-[4-(2-furanyl)-2-[[4-(1-iminoethyl)anilino]-oxomethyl]phenyl]benzoic acid IUPAC Name: 5-acetyl-2-[2-[(4-ethanimidoylphenyl)carbamoyl]-4-(furan-2-yl)phenyl]benzoic acid Traditional Name: 2-[2-[(4-acetimidoylphenyl)carbamoyl]-4-(2-furyl)phenyl]-5-acetyl-benzoic acid Formula: C28H22N2O5 MolecularWeight: 466.48468

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Descriptors Computed from Structure

Canonical SMILES:

CC(=N)C1=CC=C(C=C1)NC(=O)C2=C(C=CC(=C2)C3=CC=CO3)C4=C(C=C(C=C4)C(=O)C)C(=O)O

Isomeric SMILES

CC(=N)C1=CC=C(C=C1)NC(=O)C2=C(C=CC(=C2)C3=CC=CO3)C4=C(C=C(C=C4)C(=O)C)C(=O)O

InChI

InChI=1S/C28H22N2O5/c1-16(29)18-5-9-21(10-6-18)30-27(32)24-15-20(26-4-3-13-35-26)8-12-22(24)23-11-7-19(17(2)31)14-25(23)28(33)34/h3-15,29H,1-2H3,(H,30,32)(H,33,34)