(3-chloranyl-5-cyclopropylcarbonyloxy-phenyl) 4-(2-methylpropanoylamino)benzoate

Systemtic Name: (3-chloranyl-5-cyclopropylcarbonyloxy-phenyl) 4-(2-methylpropanoylamino)benzoate Openeye Name: [3-chloro-5-(cyclopropanecarbonyloxy)phenyl] 4-(2-methylpropanoylamino)benzoate CAS Name: 4-[(2-methyl-1-oxopropyl)amino]benzoic acid [3-chloro-5-[cyclopropyl(oxo)methoxy]phenyl] ester IUPAC Name: [3-chloro-5-(cyclopropanecarbonyloxy)phenyl] 4-(2-methylpropanoylamino)benzoate Traditional Name: 4-(isobutyrylamino)benzoic acid [3-chloro-5-(cyclopropanecarbonyloxy)phenyl] ester Formula: C21H20ClNO5 MolecularWeight: 401.8402

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H20ClNO5/c1-12(2)19(24)23-16-7-5-14(6-8-16)21(26)28-18-10-15(22)9-17(11-18)27-20(25)13-3-4-13/h5-13H,3-4H2,1-2H3,(H,23,24)