methyl 4-(2,3,3-triphenylpropanoylamino)benzoate

Systemtic Name: methyl 4-(2,3,3-triphenylpropanoylamino)benzoate Openeye Name: methyl 4-(2,3,3-triphenylpropanoylamino)benzoate CAS Name: 4-[(1-oxo-2,3,3-triphenylpropyl)amino]benzoic acid methyl ester IUPAC Name: methyl 4-(2,3,3-triphenylpropanoylamino)benzoate Traditional Name: 4-(2,3,3-triphenylpropanoylamino)benzoic acid methyl ester Formula: C29H25NO3 MolecularWeight: 435.5137

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC(=O)C(C2=CC=CC=C2)C(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC(=O)C(C2=CC=CC=C2)C(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C29H25NO3/c1-33-29(32)24-17-19-25(20-18-24)30-28(31)27(23-15-9-4-10-16-23)26(21-11-5-2-6-12-21)22-13-7-3-8-14-22/h2-20,26-27H,1H3,(H,30,31)