ethyl (2S,5R)-1-(2-azanylethanoyl)-5-(2-methylphenyl)pyrrolidine-2-carboxylate

Systemtic Name: ethyl (2S,5R)-1-(2-azanylethanoyl)-5-(2-methylphenyl)pyrrolidine-2-carboxylate Openeye Name: ethyl (2S,5R)-1-(2-aminoacetyl)-5-(o-tolyl)pyrrolidine-2-carboxylate CAS Name: (2S,5R)-1-(2-amino-1-oxoethyl)-5-(2-methylphenyl)-2-pyrrolidinecarboxylic acid ethyl ester IUPAC Name: ethyl (2S,5R)-1-(2-aminoacetyl)-5-(2-methylphenyl)pyrrolidine-2-carboxylate Traditional Name: (2S,5R)-1-glycyl-5-(o-tolyl)pyrrolidine-2-carboxylic acid ethyl ester Formula: C16H22N2O3 MolecularWeight: 290.35748

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCC(N1C(=O)CN)C2=CC=CC=C2C

Isomeric SMILES

CCOC(=O)[C@@H]1CC[C@@H](N1C(=O)CN)C2=CC=CC=C2C

InChI

InChI=1S/C16H22N2O3/c1-3-21-16(20)14-9-8-13(18(14)15(19)10-17)12-7-5-4-6-11(12)2/h4-7,13-14H,3,8-10,17H2,1-2H3/t13-,14+/m1/s1