[2-(2,3-dihydro-1H-inden-5-ylamino)-2-oxidanylidene-ethyl]-methyl-(thiophen-3-ylmethyl)azanium

Systemtic Name: [2-(2,3-dihydro-1H-inden-5-ylamino)-2-oxidanylidene-ethyl]-methyl-(thiophen-3-ylmethyl)azanium Openeye Name: [2-(indan-5-ylamino)-2-oxo-ethyl]-methyl-(3-thienylmethyl)ammonium CAS Name: [2-(2,3-dihydro-1H-inden-5-ylamino)-2-oxoethyl]-methyl-(3-thiophenylmethyl)ammonium IUPAC Name: [2-(2,3-dihydro-1H-inden-5-ylamino)-2-oxoethyl]-methyl-(thiophen-3-ylmethyl)azanium Traditional Name: [2-(indan-5-ylamino)-2-keto-ethyl]-methyl-(3-thenyl)ammonium Formula: C17H21N2OS+ MolecularWeight: 301.42644

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CSC=C1)CC(=O)NC2=CC3=C(CCC3)C=C2

Isomeric SMILES

C[NH+](CC1=CSC=C1)CC(=O)NC2=CC3=C(CCC3)C=C2

InChI

InChI=1S/C17H20N2OS/c1-19(10-13-7-8-21-12-13)11-17(20)18-16-6-5-14-3-2-4-15(14)9-16/h5-9,12H,2-4,10-11H2,1H3,(H,18,20)/p+1