(3-cyclopropylcarbonyloxyphenyl) 3-chloranyl-4-(2,2-dimethylpropanoylamino)benzoate

Systemtic Name: (3-cyclopropylcarbonyloxyphenyl) 3-chloranyl-4-(2,2-dimethylpropanoylamino)benzoate Openeye Name: [3-(cyclopropanecarbonyloxy)phenyl] 3-chloro-4-(2,2-dimethylpropanoylamino)benzoate CAS Name: 3-chloro-4-[(2,2-dimethyl-1-oxopropyl)amino]benzoic acid [3-[cyclopropyl(oxo)methoxy]phenyl] ester IUPAC Name: [3-(cyclopropanecarbonyloxy)phenyl] 3-chloro-4-(2,2-dimethylpropanoylamino)benzoate Traditional Name: 3-chloro-4-(pivaloylamino)benzoic acid [3-(cyclopropanecarbonyloxy)phenyl] ester Formula: C22H22ClNO5 MolecularWeight: 415.86678

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)NC1=C(C=C(C=C1)C(=O)OC2=CC(=CC=C2)OC(=O)C3CC3)Cl

Isomeric SMILES

CC(C)(C)C(=O)NC1=C(C=C(C=C1)C(=O)OC2=CC(=CC=C2)OC(=O)C3CC3)Cl

InChI

InChI=1S/C22H22ClNO5/c1-22(2,3)21(27)24-18-10-9-14(11-17(18)23)20(26)29-16-6-4-5-15(12-16)28-19(25)13-7-8-13/h4-6,9-13H,7-8H2,1-3H3,(H,24,27)