2-[[2-[2-(2,3-dihydro-1H-inden-5-ylamino)-2-oxidanylidene-ethoxy]phenyl]carbonylamino]ethyl-dimethyl-azanium

Systemtic Name: 2-[[2-[2-(2,3-dihydro-1H-inden-5-ylamino)-2-oxidanylidene-ethoxy]phenyl]carbonylamino]ethyl-dimethyl-azanium Openeye Name: 2-[[2-[2-(indan-5-ylamino)-2-oxo-ethoxy]benzoyl]amino]ethyl-dimethyl-ammonium CAS Name: 2-[[[2-[2-(2,3-dihydro-1H-inden-5-ylamino)-2-oxoethoxy]phenyl]-oxomethyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[[2-[2-(2,3-dihydro-1H-inden-5-ylamino)-2-oxoethoxy]benzoyl]amino]ethyl-dimethylazanium Traditional Name: 2-[[2-[2-(indan-5-ylamino)-2-keto-ethoxy]benzoyl]amino]ethyl-dimethyl-ammonium Formula: C22H28N3O3+ MolecularWeight: 382.47602

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCNC(=O)C1=CC=CC=C1OCC(=O)NC2=CC3=C(CCC3)C=C2

Isomeric SMILES

C[NH+](C)CCNC(=O)C1=CC=CC=C1OCC(=O)NC2=CC3=C(CCC3)C=C2

InChI

InChI=1S/C22H27N3O3/c1-25(2)13-12-23-22(27)19-8-3-4-9-20(19)28-15-21(26)24-18-11-10-16-6-5-7-17(16)14-18/h3-4,8-11,14H,5-7,12-13,15H2,1-2H3,(H,23,27)(H,24,26)/p+1