(2R,3S)-3-methyl-2-(3-oxidanidyl-4,5-diphenyl-imidazol-3-ium-1-yl)pentanoate

Systemtic Name: (2R,3S)-3-methyl-2-(3-oxidanidyl-4,5-diphenyl-imidazol-3-ium-1-yl)pentanoate Openeye Name: (2R,3S)-3-methyl-2-(3-oxido-4,5-diphenyl-imidazol-3-ium-1-yl)pentanoate CAS Name: (2R,3S)-3-methyl-2-(3-oxido-4,5-diphenyl-1-imidazol-3-iumyl)pentanoate IUPAC Name: (2R,3S)-3-methyl-2-(3-oxido-4,5-diphenylimidazol-3-ium-1-yl)pentanoate Traditional Name: (2R,3S)-3-methyl-2-(3-oxido-4,5-diphenyl-imidazol-3-ium-1-yl)valerate Formula: C21H21N2O3- MolecularWeight: 349.40304

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)[O-])N1C=[N+](C(=C1C2=CC=CC=C2)C3=CC=CC=C3)[O-]

Isomeric SMILES

CC[C@H](C)[C@H](C(=O)[O-])N1C=[N+](C(=C1C2=CC=CC=C2)C3=CC=CC=C3)[O-]

InChI

InChI=1S/C21H22N2O3/c1-3-15(2)18(21(24)25)22-14-23(26)20(17-12-8-5-9-13-17)19(22)16-10-6-4-7-11-16/h4-15,18H,3H2,1-2H3,(H,24,25)/p-1/t15-,18+/m0/s1