5-chloranyl-2-[1-(3-methylbutylamino)-1-oxidanylidene-propan-2-yl]oxy-benzoic acid

Systemtic Name: 5-chloranyl-2-[1-(3-methylbutylamino)-1-oxidanylidene-propan-2-yl]oxy-benzoic acid Openeye Name: 5-chloro-2-[2-(isopentylamino)-1-methyl-2-oxo-ethoxy]benzoic acid CAS Name: 5-chloro-2-[1-(3-methylbutylamino)-1-oxopropan-2-yl]oxybenzoic acid IUPAC Name: 5-chloro-2-[1-(3-methylbutylamino)-1-oxopropan-2-yl]oxybenzoic acid Traditional Name: 5-chloro-2-[2-(isoamylamino)-2-keto-1-methyl-ethoxy]benzoic acid Formula: C15H20ClNO4 MolecularWeight: 313.7766

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)C(C)OC1=C(C=C(C=C1)Cl)C(=O)O

Isomeric SMILES

CC(C)CCNC(=O)C(C)OC1=C(C=C(C=C1)Cl)C(=O)O

InChI

InChI=1S/C15H20ClNO4/c1-9(2)6-7-17-14(18)10(3)21-13-5-4-11(16)8-12(13)15(19)20/h4-5,8-10H,6-7H2,1-3H3,(H,17,18)(H,19,20)