methyl (2S,4R)-1-(3,3-dimethylazirin-2-yl)-4-phenylmethoxy-pyrrolidine-2-carboxylate

Systemtic Name: methyl (2S,4R)-1-(3,3-dimethylazirin-2-yl)-4-phenylmethoxy-pyrrolidine-2-carboxylate Openeye Name: methyl (2S,4R)-4-benzyloxy-1-(3,3-dimethylazirin-2-yl)pyrrolidine-2-carboxylate CAS Name: (2S,4R)-1-(3,3-dimethyl-2-azirinyl)-4-phenylmethoxy-2-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl (2S,4R)-1-(3,3-dimethylazirin-2-yl)-4-phenylmethoxypyrrolidine-2-carboxylate Traditional Name: (2S,4R)-4-benzoxy-1-(3,3-dimethylazirin-2-yl)pyrrolidine-2-carboxylic acid methyl ester Formula: C17H22N2O3 MolecularWeight: 302.36818

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=N1)N2CC(CC2C(=O)OC)OCC3=CC=CC=C3)C

Isomeric SMILES

CC1(C(=N1)N2C[C@@H](C[C@H]2C(=O)OC)OCC3=CC=CC=C3)C

InChI

InChI=1S/C17H22N2O3/c1-17(2)16(18-17)19-10-13(9-14(19)15(20)21-3)22-11-12-7-5-4-6-8-12/h4-8,13-14H,9-11H2,1-3H3/t13-,14+/m1/s1