methyl-[(4S)-4-oxidanyl-4-pyridin-3-yl-butyl]-propylidene-azanium

Systemtic Name: methyl-[(4S)-4-oxidanyl-4-pyridin-3-yl-butyl]-propylidene-azanium Openeye Name: [(4S)-4-hydroxy-4-(3-pyridyl)butyl]-methyl-propylidene-ammonium CAS Name: [(4S)-4-hydroxy-4-(3-pyridinyl)butyl]-methyl-propylideneammonium IUPAC Name: [(4S)-4-hydroxy-4-pyridin-3-ylbutyl]-methyl-propylideneazanium Traditional Name: [(4S)-4-hydroxy-4-(3-pyridyl)butyl]-methyl-propylidene-ammonium Formula: C13H21N2O+ MolecularWeight: 221.31864

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Descriptors Computed from Structure

Canonical SMILES:

CCC=[N+](C)CCCC(C1=CN=CC=C1)O

Isomeric SMILES

CCC=[N+](C)CCC[C@@H](C1=CN=CC=C1)O

InChI

InChI=1S/C13H21N2O/c1-3-9-15(2)10-5-7-13(16)12-6-4-8-14-11-12/h4,6,8-9,11,13,16H,3,5,7,10H2,1-2H3/q+1/t13-/m0/s1