2-[[(2-benzamido-1-phenyl-ethyl)-phenyl-amino]methyl]furan-3-carboxylic acid

Systemtic Name: 2-[[(2-benzamido-1-phenyl-ethyl)-phenyl-amino]methyl]furan-3-carboxylic acid Openeye Name: 2-[(N-(2-benzamido-1-phenyl-ethyl)anilino)methyl]furan-3-carboxylic acid CAS Name: 2-[(N-(2-benzamido-1-phenylethyl)anilino)methyl]-3-furancarboxylic acid IUPAC Name: 2-[(N-(2-benzamido-1-phenylethyl)anilino)methyl]furan-3-carboxylic acid Traditional Name: 2-[(N-(2-benzamido-1-phenyl-ethyl)anilino)methyl]-3-furoic acid Formula: C27H24N2O4 MolecularWeight: 440.49046

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CNC(=O)C2=CC=CC=C2)N(CC3=C(C=CO3)C(=O)O)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C(CNC(=O)C2=CC=CC=C2)N(CC3=C(C=CO3)C(=O)O)C4=CC=CC=C4

InChI

InChI=1S/C27H24N2O4/c30-26(21-12-6-2-7-13-21)28-18-24(20-10-4-1-5-11-20)29(22-14-8-3-9-15-22)19-25-23(27(31)32)16-17-33-25/h1-17,24H,18-19H2,(H,28,30)(H,31,32)