[4-(2-azanyl-2-oxidanylidene-ethoxy)phenyl]methyl-[[(2S)-1-ethylpyrrolidin-2-yl]methyl]azanium

Systemtic Name: [4-(2-azanyl-2-oxidanylidene-ethoxy)phenyl]methyl-[[(2S)-1-ethylpyrrolidin-2-yl]methyl]azanium Openeye Name: [4-(2-amino-2-oxo-ethoxy)phenyl]methyl-[[(2S)-1-ethylpyrrolidin-2-yl]methyl]ammonium CAS Name: [4-(2-amino-2-oxoethoxy)phenyl]methyl-[[(2S)-1-ethyl-2-pyrrolidinyl]methyl]ammonium IUPAC Name: [4-(2-amino-2-oxoethoxy)phenyl]methyl-[[(2S)-1-ethylpyrrolidin-2-yl]methyl]azanium Traditional Name: [4-(2-amino-2-keto-ethoxy)benzyl]-[[(2S)-1-ethylpyrrolidin-2-yl]methyl]ammonium Formula: C16H26N3O2+ MolecularWeight: 292.39654

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCCC1C[NH2+]CC2=CC=C(C=C2)OCC(=O)N

Isomeric SMILES

CCN1CCC[C@H]1C[NH2+]CC2=CC=C(C=C2)OCC(=O)N

InChI

InChI=1S/C16H25N3O2/c1-2-19-9-3-4-14(19)11-18-10-13-5-7-15(8-6-13)21-12-16(17)20/h5-8,14,18H,2-4,9-12H2,1H3,(H2,17,20)/p+1/t14-/m0/s1