4-[(3-benzamido-4-ethanoyl-2-propyl-phenoxy)methyl]-3-methoxy-benzoic acid

Systemtic Name: 4-[(3-benzamido-4-ethanoyl-2-propyl-phenoxy)methyl]-3-methoxy-benzoic acid Openeye Name: 4-[(4-acetyl-3-benzamido-2-propyl-phenoxy)methyl]-3-methoxy-benzoic acid CAS Name: 4-[(4-acetyl-3-benzamido-2-propylphenoxy)methyl]-3-methoxybenzoic acid IUPAC Name: 4-[(4-acetyl-3-benzamido-2-propylphenoxy)methyl]-3-methoxybenzoic acid Traditional Name: 4-[(4-acetyl-3-benzamido-2-propyl-phenoxy)methyl]-3-methoxy-benzoic acid Formula: C27H27NO6 MolecularWeight: 461.50638

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1NC(=O)C2=CC=CC=C2)C(=O)C)OCC3=C(C=C(C=C3)C(=O)O)OC

Isomeric SMILES

CCCC1=C(C=CC(=C1NC(=O)C2=CC=CC=C2)C(=O)C)OCC3=C(C=C(C=C3)C(=O)O)OC

InChI

InChI=1S/C27H27NO6/c1-4-8-22-23(34-16-20-12-11-19(27(31)32)15-24(20)33-3)14-13-21(17(2)29)25(22)28-26(30)18-9-6-5-7-10-18/h5-7,9-15H,4,8,16H2,1-3H3,(H,28,30)(H,31,32)