methyl 2-(3-methylphenyl)-1-(2-phenoxyethanoyl)-5-piperazin-1-ylcarbonyl-pyrrolidine-3-carboxylate

Systemtic Name: methyl 2-(3-methylphenyl)-1-(2-phenoxyethanoyl)-5-piperazin-1-ylcarbonyl-pyrrolidine-3-carboxylate Openeye Name: methyl 2-(m-tolyl)-1-(2-phenoxyacetyl)-5-(piperazine-1-carbonyl)pyrrolidine-3-carboxylate CAS Name: 2-(3-methylphenyl)-1-(1-oxo-2-phenoxyethyl)-5-[oxo(1-piperazinyl)methyl]-3-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl 2-(3-methylphenyl)-1-(2-phenoxyacetyl)-5-(piperazine-1-carbonyl)pyrrolidine-3-carboxylate Traditional Name: 2-(m-tolyl)-1-(2-phenoxyacetyl)-5-(piperazine-1-carbonyl)pyrrolidine-3-carboxylic acid methyl ester Formula: C26H31N3O5 MolecularWeight: 465.54144

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2C(CC(N2C(=O)COC3=CC=CC=C3)C(=O)N4CCNCC4)C(=O)OC

Isomeric SMILES

CC1=CC=CC(=C1)C2C(CC(N2C(=O)COC3=CC=CC=C3)C(=O)N4CCNCC4)C(=O)OC

InChI

InChI=1S/C26H31N3O5/c1-18-7-6-8-19(15-18)24-21(26(32)33-2)16-22(25(31)28-13-11-27-12-14-28)29(24)23(30)17-34-20-9-4-3-5-10-20/h3-10,15,21-22,24,27H,11-14,16-17H2,1-2H3