[6-[(3-ethynylphenyl)amino]-6-oxidanylidene-hexyl]azanium

Systemtic Name: [6-[(3-ethynylphenyl)amino]-6-oxidanylidene-hexyl]azanium Openeye Name: [6-(3-ethynylanilino)-6-oxo-hexyl]ammonium CAS Name: [6-(3-ethynylanilino)-6-oxohexyl]ammonium IUPAC Name: [6-(3-ethynylanilino)-6-oxohexyl]azanium Traditional Name: [6-(3-ethynylanilino)-6-keto-hexyl]ammonium Formula: C14H19N2O+ MolecularWeight: 231.31346

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1=CC(=CC=C1)NC(=O)CCCCC[NH3+]

Isomeric SMILES

C#CC1=CC(=CC=C1)NC(=O)CCCCC[NH3+]

InChI

InChI=1S/C14H18N2O/c1-2-12-7-6-8-13(11-12)16-14(17)9-4-3-5-10-15/h1,6-8,11H,3-5,9-10,15H2,(H,16,17)/p+1