methyl (2S)-1-[[5-methyl-2-(4-phenylphenyl)-1,3-oxazol-4-yl]methyl]pyrrolidin-1-ium-2-carboxylate

Systemtic Name: methyl (2S)-1-[[5-methyl-2-(4-phenylphenyl)-1,3-oxazol-4-yl]methyl]pyrrolidin-1-ium-2-carboxylate Openeye Name: methyl (2S)-1-[[5-methyl-2-(4-phenylphenyl)oxazol-4-yl]methyl]pyrrolidin-1-ium-2-carboxylate CAS Name: (2S)-1-[[5-methyl-2-(4-phenylphenyl)-4-oxazolyl]methyl]-2-pyrrolidin-1-iumcarboxylic acid methyl ester IUPAC Name: methyl (2S)-1-[[5-methyl-2-(4-phenylphenyl)-1,3-oxazol-4-yl]methyl]pyrrolidin-1-ium-2-carboxylate Traditional Name: (2S)-1-[[5-methyl-2-(4-phenylphenyl)oxazol-4-yl]methyl]pyrrolidin-1-ium-2-carboxylic acid methyl ester Formula: C23H25N2O3+ MolecularWeight: 377.4562

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(O1)C2=CC=C(C=C2)C3=CC=CC=C3)C[NH+]4CCCC4C(=O)OC

Isomeric SMILES

CC1=C(N=C(O1)C2=CC=C(C=C2)C3=CC=CC=C3)C[NH+]4CCC[C@H]4C(=O)OC

InChI

InChI=1S/C23H24N2O3/c1-16-20(15-25-14-6-9-21(25)23(26)27-2)24-22(28-16)19-12-10-18(11-13-19)17-7-4-3-5-8-17/h3-5,7-8,10-13,21H,6,9,14-15H2,1-2H3/p+1/t21-/m0/s1