methyl 3-[4-[3-(4-tert-butylphenyl)propanoylamino]phenyl]benzoate

Systemtic Name: methyl 3-[4-[3-(4-tert-butylphenyl)propanoylamino]phenyl]benzoate Openeye Name: methyl 3-[4-[3-(4-tert-butylphenyl)propanoylamino]phenyl]benzoate CAS Name: 3-[4-[[3-(4-tert-butylphenyl)-1-oxopropyl]amino]phenyl]benzoic acid methyl ester IUPAC Name: methyl 3-[4-[3-(4-tert-butylphenyl)propanoylamino]phenyl]benzoate Traditional Name: 3-[4-[3-(4-tert-butylphenyl)propanoylamino]phenyl]benzoic acid methyl ester Formula: C27H29NO3 MolecularWeight: 415.52406

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CCC(=O)NC2=CC=C(C=C2)C3=CC(=CC=C3)C(=O)OC

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CCC(=O)NC2=CC=C(C=C2)C3=CC(=CC=C3)C(=O)OC

InChI

InChI=1S/C27H29NO3/c1-27(2,3)23-13-8-19(9-14-23)10-17-25(29)28-24-15-11-20(12-16-24)21-6-5-7-22(18-21)26(30)31-4/h5-9,11-16,18H,10,17H2,1-4H3,(H,28,29)