4-[[[3-chloranyl-5-methoxy-4-(2-methylpropoxy)phenyl]carbonylamino]methyl]benzoic acid

Systemtic Name: 4-[[[3-chloranyl-5-methoxy-4-(2-methylpropoxy)phenyl]carbonylamino]methyl]benzoic acid Openeye Name: 4-[[(3-chloro-4-isobutoxy-5-methoxy-benzoyl)amino]methyl]benzoic acid CAS Name: 4-[[[[3-chloro-5-methoxy-4-(2-methylpropoxy)phenyl]-oxomethyl]amino]methyl]benzoic acid IUPAC Name: 4-[[[3-chloro-5-methoxy-4-(2-methylpropoxy)benzoyl]amino]methyl]benzoic acid Traditional Name: 4-[[(3-chloro-4-isobutoxy-5-methoxy-benzoyl)amino]methyl]benzoic acid Formula: C20H22ClNO5 MolecularWeight: 391.84538

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=C(C=C(C=C1Cl)C(=O)NCC2=CC=C(C=C2)C(=O)O)OC

Isomeric SMILES

CC(C)COC1=C(C=C(C=C1Cl)C(=O)NCC2=CC=C(C=C2)C(=O)O)OC

InChI

InChI=1S/C20H22ClNO5/c1-12(2)11-27-18-16(21)8-15(9-17(18)26-3)19(23)22-10-13-4-6-14(7-5-13)20(24)25/h4-9,12H,10-11H2,1-3H3,(H,22,23)(H,24,25)