[(2S,3R)-1-imidazol-1-yl-3-methyl-1-oxidanylidene-pentan-2-yl]-(triphenylmethyl)azanium

Systemtic Name: [(2S,3R)-1-imidazol-1-yl-3-methyl-1-oxidanylidene-pentan-2-yl]-(triphenylmethyl)azanium Openeye Name: [(1S,2R)-1-(imidazole-1-carbonyl)-2-methyl-butyl]-trityl-ammonium CAS Name: [(2S,3R)-1-(1-imidazolyl)-3-methyl-1-oxopentan-2-yl]-(triphenylmethyl)ammonium IUPAC Name: [(2S,3R)-1-imidazol-1-yl-3-methyl-1-oxopentan-2-yl]-tritylazanium Traditional Name: [(1S,2R)-1-(imidazole-1-carbonyl)-2-methyl-butyl]-trityl-ammonium Formula: C28H30N3O+ MolecularWeight: 424.5573

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)N1C=CN=C1)[NH2+]C(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC[C@@H](C)[C@@H](C(=O)N1C=CN=C1)[NH2+]C(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C28H29N3O/c1-3-22(2)26(27(32)31-20-19-29-21-31)30-28(23-13-7-4-8-14-23,24-15-9-5-10-16-24)25-17-11-6-12-18-25/h4-22,26,30H,3H2,1-2H3/p+1/t22-,26+/m1/s1