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

Systemtic Name: 3-[[4-(2-azanyl-2-oxidanylidene-ethoxy)-3-methoxy-phenyl]methylazaniumyl]propyl-diethyl-azanium Openeye Name: 3-[[4-(2-amino-2-oxo-ethoxy)-3-methoxy-phenyl]methylammonio]propyl-diethyl-ammonium CAS Name: 3-[[4-(2-amino-2-oxoethoxy)-3-methoxyphenyl]methylammonio]propyl-diethylammonium IUPAC Name: 3-[[4-(2-amino-2-oxoethoxy)-3-methoxyphenyl]methylazaniumyl]propyl-diethylazanium Traditional Name: 3-[[4-(2-amino-2-keto-ethoxy)-3-methoxy-benzyl]ammonio]propyl-diethyl-ammonium Formula: C17H31N3O3+2 MolecularWeight: 325.44634

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H29N3O3/c1-4-20(5-2)10-6-9-19-12-14-7-8-15(16(11-14)22-3)23-13-17(18)21/h7-8,11,19H,4-6,9-10,12-13H2,1-3H3,(H2,18,21)/p+2