(4-pyrrolidin-1-ylcarbonylphenyl)methyl 2-(4-methylphenyl)carbonylbenzoate

Systemtic Name: (4-pyrrolidin-1-ylcarbonylphenyl)methyl 2-(4-methylphenyl)carbonylbenzoate Openeye Name: [4-(pyrrolidine-1-carbonyl)phenyl]methyl 2-(4-methylbenzoyl)benzoate CAS Name: 2-[(4-methylphenyl)-oxomethyl]benzoic acid [4-[oxo(1-pyrrolidinyl)methyl]phenyl]methyl ester IUPAC Name: [4-(pyrrolidine-1-carbonyl)phenyl]methyl 2-(4-methylbenzoyl)benzoate Traditional Name: 2-p-toluoylbenzoic acid [4-(pyrrolidine-1-carbonyl)benzyl] ester Formula: C27H25NO4 MolecularWeight: 427.4917

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C2=CC=CC=C2C(=O)OCC3=CC=C(C=C3)C(=O)N4CCCC4

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C2=CC=CC=C2C(=O)OCC3=CC=C(C=C3)C(=O)N4CCCC4

InChI

InChI=1S/C27H25NO4/c1-19-8-12-21(13-9-19)25(29)23-6-2-3-7-24(23)27(31)32-18-20-10-14-22(15-11-20)26(30)28-16-4-5-17-28/h2-3,6-15H,4-5,16-18H2,1H3