3-chloranyl-4-methoxy-5-[(3-phenylmethoxyphenyl)carbonylamino]benzoic acid

Systemtic Name: 3-chloranyl-4-methoxy-5-[(3-phenylmethoxyphenyl)carbonylamino]benzoic acid Openeye Name: 3-[(3-benzyloxybenzoyl)amino]-5-chloro-4-methoxy-benzoic acid CAS Name: 3-chloro-4-methoxy-5-[[oxo-(3-phenylmethoxyphenyl)methyl]amino]benzoic acid IUPAC Name: 3-chloro-4-methoxy-5-[(3-phenylmethoxybenzoyl)amino]benzoic acid Traditional Name: 3-[(3-benzoxybenzoyl)amino]-5-chloro-4-methoxy-benzoic acid Formula: C22H18ClNO5 MolecularWeight: 411.83502

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1Cl)C(=O)O)NC(=O)C2=CC(=CC=C2)OCC3=CC=CC=C3

Isomeric SMILES

COC1=C(C=C(C=C1Cl)C(=O)O)NC(=O)C2=CC(=CC=C2)OCC3=CC=CC=C3

InChI

InChI=1S/C22H18ClNO5/c1-28-20-18(23)11-16(22(26)27)12-19(20)24-21(25)15-8-5-9-17(10-15)29-13-14-6-3-2-4-7-14/h2-12H,13H2,1H3,(H,24,25)(H,26,27)