methyl (2S,4R)-4-[3,3-dimethylbutanoyl-[(4-methoxyphenyl)methyl]amino]pyrrolidine-2-carboxylate

Systemtic Name: methyl (2S,4R)-4-[3,3-dimethylbutanoyl-[(4-methoxyphenyl)methyl]amino]pyrrolidine-2-carboxylate Openeye Name: methyl (2S,4R)-4-[3,3-dimethylbutanoyl-[(4-methoxyphenyl)methyl]amino]pyrrolidine-2-carboxylate CAS Name: (2S,4R)-4-[(3,3-dimethyl-1-oxobutyl)-[(4-methoxyphenyl)methyl]amino]-2-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl (2S,4R)-4-[3,3-dimethylbutanoyl-[(4-methoxyphenyl)methyl]amino]pyrrolidine-2-carboxylate Traditional Name: (2S,4R)-4-[3,3-dimethylbutanoyl(p-anisyl)amino]pyrrolidine-2-carboxylic acid methyl ester Formula: C20H30N2O4 MolecularWeight: 362.4632

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(=O)N(CC1=CC=C(C=C1)OC)C2CC(NC2)C(=O)OC

Isomeric SMILES

CC(C)(C)CC(=O)N(CC1=CC=C(C=C1)OC)[C@@H]2C[C@H](NC2)C(=O)OC

InChI

InChI=1S/C20H30N2O4/c1-20(2,3)11-18(23)22(13-14-6-8-16(25-4)9-7-14)15-10-17(21-12-15)19(24)26-5/h6-9,15,17,21H,10-13H2,1-5H3/t15-,17+/m1/s1