methyl (2S)-1-(3,5-dimethyl-2-oxidanidyl-5-phenyl-4,6-dihydro-1,2-oxazin-2-ium-6-yl)pyrrolidine-2-carboxylate

Systemtic Name: methyl (2S)-1-(3,5-dimethyl-2-oxidanidyl-5-phenyl-4,6-dihydro-1,2-oxazin-2-ium-6-yl)pyrrolidine-2-carboxylate Openeye Name: methyl (2S)-1-(3,5-dimethyl-2-oxido-5-phenyl-4,6-dihydrooxazin-2-ium-6-yl)pyrrolidine-2-carboxylate CAS Name: (2S)-1-(3,5-dimethyl-2-oxido-5-phenyl-4,6-dihydrooxazin-2-ium-6-yl)-2-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl (2S)-1-(3,5-dimethyl-2-oxido-5-phenyl-4,6-dihydrooxazin-2-ium-6-yl)pyrrolidine-2-carboxylate Traditional Name: (2S)-1-(3,5-dimethyl-2-oxido-5-phenyl-4,6-dihydrooxazin-2-ium-6-yl)pyrrolidine-2-carboxylic acid methyl ester Formula: C18H24N2O4 MolecularWeight: 332.39416

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](OC(C(C1)(C)C2=CC=CC=C2)N3CCCC3C(=O)OC)[O-]

Isomeric SMILES

CC1=[N+](OC(C(C1)(C)C2=CC=CC=C2)N3CCC[C@H]3C(=O)OC)[O-]

InChI

InChI=1S/C18H24N2O4/c1-13-12-18(2,14-8-5-4-6-9-14)17(24-20(13)22)19-11-7-10-15(19)16(21)23-3/h4-6,8-9,15,17H,7,10-12H2,1-3H3/t15-,17?,18?/m0/s1