[2-(1-adamantylamino)-2-oxidanylidene-ethyl]-methyl-(thiophen-3-ylmethyl)azanium

Systemtic Name: [2-(1-adamantylamino)-2-oxidanylidene-ethyl]-methyl-(thiophen-3-ylmethyl)azanium Openeye Name: [2-(1-adamantylamino)-2-oxo-ethyl]-methyl-(3-thienylmethyl)ammonium CAS Name: [2-(1-adamantylamino)-2-oxoethyl]-methyl-(3-thiophenylmethyl)ammonium IUPAC Name: [2-(1-adamantylamino)-2-oxoethyl]-methyl-(thiophen-3-ylmethyl)azanium Traditional Name: [2-(1-adamantylamino)-2-keto-ethyl]-methyl-(3-thenyl)ammonium Formula: C18H27N2OS+ MolecularWeight: 319.48478

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CSC=C1)CC(=O)NC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

C[NH+](CC1=CSC=C1)CC(=O)NC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C18H26N2OS/c1-20(10-13-2-3-22-12-13)11-17(21)19-18-7-14-4-15(8-18)6-16(5-14)9-18/h2-3,12,14-16H,4-11H2,1H3,(H,19,21)/p+1