(5Z)-2-butyl-4-cyclopentyl-5-(1-iodanylethylidene)-4-methyl-3-(2-phenylpropyl)-1,3-oxazol-3-ium iodide

Systemtic Name: (5Z)-2-butyl-4-cyclopentyl-5-(1-iodanylethylidene)-4-methyl-3-(2-phenylpropyl)-1,3-oxazol-3-ium iodide Openeye Name: (5Z)-2-butyl-4-cyclopentyl-5-(1-iodoethylidene)-4-methyl-3-(2-phenylpropyl)oxazol-3-ium iodide CAS Name: (5Z)-2-butyl-4-cyclopentyl-5-(1-iodoethylidene)-4-methyl-3-(2-phenylpropyl)oxazol-3-ium iodide IUPAC Name: (5Z)-2-butyl-4-cyclopentyl-5-(1-iodoethylidene)-4-methyl-3-(2-phenylpropyl)-1,3-oxazol-3-ium iodide Traditional Name: (5Z)-2-butyl-4-cyclopentyl-5-(1-iodoethylidene)-4-methyl-3-(2-phenylpropyl)-2-oxazolin-3-ium iodide Formula: C24H35I2NO MolecularWeight: 607.34974

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=[N+](C(C(=C(C)I)O1)(C)C2CCCC2)CC(C)C3=CC=CC=C3.[I-]

Isomeric SMILES

CCCCC1=[N+](C(/C(=C(\C)/I)/O1)(C)C2CCCC2)CC(C)C3=CC=CC=C3.[I-]

InChI

InChI=1S/C24H35INO.HI/c1-5-6-16-22-26(17-18(2)20-12-8-7-9-13-20)24(4,21-14-10-11-15-21)23(27-22)19(3)25;/h7-9,12-13,18,21H,5-6,10-11,14-17H2,1-4H3;1H/q+1;/p-1/b23-19-;