3-[[4-(2-azanyl-2-oxidanylidene-ethoxy)phenyl]methylazaniumyl]propyl-diethyl-azanium

Systemtic Name: 3-[[4-(2-azanyl-2-oxidanylidene-ethoxy)phenyl]methylazaniumyl]propyl-diethyl-azanium Openeye Name: 3-[[4-(2-amino-2-oxo-ethoxy)phenyl]methylammonio]propyl-diethyl-ammonium CAS Name: 3-[[4-(2-amino-2-oxoethoxy)phenyl]methylammonio]propyl-diethylammonium IUPAC Name: 3-[[4-(2-amino-2-oxoethoxy)phenyl]methylazaniumyl]propyl-diethylazanium Traditional Name: 3-[[4-(2-amino-2-keto-ethoxy)benzyl]ammonio]propyl-diethyl-ammonium Formula: C16H29N3O2+2 MolecularWeight: 295.42036

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCC[NH2+]CC1=CC=C(C=C1)OCC(=O)N

Isomeric SMILES

CC[NH+](CC)CCC[NH2+]CC1=CC=C(C=C1)OCC(=O)N

InChI

InChI=1S/C16H27N3O2/c1-3-19(4-2)11-5-10-18-12-14-6-8-15(9-7-14)21-13-16(17)20/h6-9,18H,3-5,10-13H2,1-2H3,(H2,17,20)/p+2