[2-[(3-aminophenyl)amino]-2-oxidanylidene-ethyl]-pentan-3-yl-azanium iodide

Systemtic Name: [2-[(3-aminophenyl)amino]-2-oxidanylidene-ethyl]-pentan-3-yl-azanium iodide Openeye Name: [2-(3-aminoanilino)-2-oxo-ethyl]-(1-ethylpropyl)ammonium iodide CAS Name: [2-(3-aminoanilino)-2-oxoethyl]-pentan-3-ylammonium iodide IUPAC Name: [2-(3-aminoanilino)-2-oxoethyl]-pentan-3-ylazanium iodide Traditional Name: [2-(3-aminoanilino)-2-keto-ethyl]-(1-ethylpropyl)ammonium iodide Formula: C13H22IN3O MolecularWeight: 363.23775

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)[NH2+]CC(=O)NC1=CC=CC(=C1)N.[I-]

Isomeric SMILES

CCC(CC)[NH2+]CC(=O)NC1=CC=CC(=C1)N.[I-]

InChI

InChI=1S/C13H21N3O.HI/c1-3-11(4-2)15-9-13(17)16-12-7-5-6-10(14)8-12;/h5-8,11,15H,3-4,9,14H2,1-2H3,(H,16,17);1H