ethyl 4-[3-(4-tert-butylphenyl)propanoylamino]-2-chloranyl-benzoate

Systemtic Name: ethyl 4-[3-(4-tert-butylphenyl)propanoylamino]-2-chloranyl-benzoate Openeye Name: ethyl 4-[3-(4-tert-butylphenyl)propanoylamino]-2-chloro-benzoate CAS Name: 4-[[3-(4-tert-butylphenyl)-1-oxopropyl]amino]-2-chlorobenzoic acid ethyl ester IUPAC Name: ethyl 4-[3-(4-tert-butylphenyl)propanoylamino]-2-chlorobenzoate Traditional Name: 4-[3-(4-tert-butylphenyl)propanoylamino]-2-chloro-benzoic acid ethyl ester Formula: C22H26ClNO3 MolecularWeight: 387.89974

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(C=C1)NC(=O)CCC2=CC=C(C=C2)C(C)(C)C)Cl

Isomeric SMILES

CCOC(=O)C1=C(C=C(C=C1)NC(=O)CCC2=CC=C(C=C2)C(C)(C)C)Cl

InChI

InChI=1S/C22H26ClNO3/c1-5-27-21(26)18-12-11-17(14-19(18)23)24-20(25)13-8-15-6-9-16(10-7-15)22(2,3)4/h6-7,9-12,14H,5,8,13H2,1-4H3,(H,24,25)