2-[(2S)-5-oxidanylidene-1-(3-pyridin-4-ylpropyl)pyrrolidin-2-yl]ethyl-prop-2-enyl-azanium

Systemtic Name: 2-[(2S)-5-oxidanylidene-1-(3-pyridin-4-ylpropyl)pyrrolidin-2-yl]ethyl-prop-2-enyl-azanium Openeye Name: allyl-[2-[(2S)-5-oxo-1-[3-(4-pyridyl)propyl]pyrrolidin-2-yl]ethyl]ammonium CAS Name: 2-[(2S)-5-oxo-1-(3-pyridin-4-ylpropyl)-2-pyrrolidinyl]ethyl-prop-2-enylammonium IUPAC Name: 2-[(2S)-5-oxo-1-(3-pyridin-4-ylpropyl)pyrrolidin-2-yl]ethyl-prop-2-enylazanium Traditional Name: allyl-[2-[(2S)-5-keto-1-[3-(4-pyridyl)propyl]pyrrolidin-2-yl]ethyl]ammonium Formula: C17H26N3O+ MolecularWeight: 288.40784

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Descriptors Computed from Structure

Canonical SMILES:

C=CC[NH2+]CCC1CCC(=O)N1CCCC2=CC=NC=C2

Isomeric SMILES

C=CC[NH2+]CC[C@@H]1CCC(=O)N1CCCC2=CC=NC=C2

InChI

InChI=1S/C17H25N3O/c1-2-10-18-13-9-16-5-6-17(21)20(16)14-3-4-15-7-11-19-12-8-15/h2,7-8,11-12,16,18H,1,3-6,9-10,13-14H2/p+1/t16-/m0/s1