(4-pyrrolidin-1-ylcarbonylphenyl)methyl 2,4,5-trimethoxybenzoate

Systemtic Name: (4-pyrrolidin-1-ylcarbonylphenyl)methyl 2,4,5-trimethoxybenzoate Openeye Name: [4-(pyrrolidine-1-carbonyl)phenyl]methyl 2,4,5-trimethoxybenzoate CAS Name: 2,4,5-trimethoxybenzoic acid [4-[oxo(1-pyrrolidinyl)methyl]phenyl]methyl ester IUPAC Name: [4-(pyrrolidine-1-carbonyl)phenyl]methyl 2,4,5-trimethoxybenzoate Traditional Name: 2,4,5-trimethoxybenzoic acid [4-(pyrrolidine-1-carbonyl)benzyl] ester Formula: C22H25NO6 MolecularWeight: 399.437

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C(=O)OCC2=CC=C(C=C2)C(=O)N3CCCC3)OC)OC

Isomeric SMILES

COC1=CC(=C(C=C1C(=O)OCC2=CC=C(C=C2)C(=O)N3CCCC3)OC)OC

InChI

InChI=1S/C22H25NO6/c1-26-18-13-20(28-3)19(27-2)12-17(18)22(25)29-14-15-6-8-16(9-7-15)21(24)23-10-4-5-11-23/h6-9,12-13H,4-5,10-11,14H2,1-3H3