ethyl 5-(1,3-benzodioxol-5-ylmethylcarbamoyl)-4-methyl-1-morpholin-4-ylcarbonyl-2-phenyl-pyrrolidine-3-carboxylate

Systemtic Name: ethyl 5-(1,3-benzodioxol-5-ylmethylcarbamoyl)-4-methyl-1-morpholin-4-ylcarbonyl-2-phenyl-pyrrolidine-3-carboxylate Openeye Name: ethyl 5-(1,3-benzodioxol-5-ylmethylcarbamoyl)-4-methyl-1-(morpholine-4-carbonyl)-2-phenyl-pyrrolidine-3-carboxylate CAS Name: 5-[(1,3-benzodioxol-5-ylmethylamino)-oxomethyl]-4-methyl-1-[4-morpholinyl(oxo)methyl]-2-phenyl-3-pyrrolidinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(1,3-benzodioxol-5-ylmethylcarbamoyl)-4-methyl-1-(morpholine-4-carbonyl)-2-phenylpyrrolidine-3-carboxylate Traditional Name: 4-methyl-1-(morpholine-4-carbonyl)-2-phenyl-5-(piperonylcarbamoyl)pyrrolidine-3-carboxylic acid ethyl ester Formula: C28H33N3O7 MolecularWeight: 523.57752

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(C(N(C1C2=CC=CC=C2)C(=O)N3CCOCC3)C(=O)NCC4=CC5=C(C=C4)OCO5)C

Isomeric SMILES

CCOC(=O)C1C(C(N(C1C2=CC=CC=C2)C(=O)N3CCOCC3)C(=O)NCC4=CC5=C(C=C4)OCO5)C

InChI

InChI=1S/C28H33N3O7/c1-3-36-27(33)23-18(2)24(26(32)29-16-19-9-10-21-22(15-19)38-17-37-21)31(25(23)20-7-5-4-6-8-20)28(34)30-11-13-35-14-12-30/h4-10,15,18,23-25H,3,11-14,16-17H2,1-2H3,(H,29,32)