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

Systemtic Name: 4-[[3-chloranyl-5-methoxy-4-(3-methylbutoxy)phenyl]carbonylamino]-3-methyl-benzoic acid Openeye Name: 4-[(3-chloro-4-isopentyloxy-5-methoxy-benzoyl)amino]-3-methyl-benzoic acid CAS Name: 4-[[[3-chloro-5-methoxy-4-(3-methylbutoxy)phenyl]-oxomethyl]amino]-3-methylbenzoic acid IUPAC Name: 4-[[3-chloro-5-methoxy-4-(3-methylbutoxy)benzoyl]amino]-3-methylbenzoic acid Traditional Name: 4-[(3-chloro-4-isoamoxy-5-methoxy-benzoyl)amino]-3-methyl-benzoic acid Formula: C21H24ClNO5 MolecularWeight: 405.87196

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)O)NC(=O)C2=CC(=C(C(=C2)Cl)OCCC(C)C)OC

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)O)NC(=O)C2=CC(=C(C(=C2)Cl)OCCC(C)C)OC

InChI

InChI=1S/C21H24ClNO5/c1-12(2)7-8-28-19-16(22)10-15(11-18(19)27-4)20(24)23-17-6-5-14(21(25)26)9-13(17)3/h5-6,9-12H,7-8H2,1-4H3,(H,23,24)(H,25,26)