(3S)-3-(3-phenylpropoxymethyl)pyrrolidin-1-ium

Systemtic Name: (3S)-3-(3-phenylpropoxymethyl)pyrrolidin-1-ium Openeye Name: (3S)-3-(3-phenylpropoxymethyl)pyrrolidin-1-ium CAS Name: (3S)-3-(3-phenylpropoxymethyl)pyrrolidin-1-ium IUPAC Name: (3S)-3-(3-phenylpropoxymethyl)pyrrolidin-1-ium Traditional Name: (3S)-3-(3-phenylpropoxymethyl)pyrrolidin-1-ium Formula: C14H22NO+ MolecularWeight: 220.33058

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH2+]CC1COCCCC2=CC=CC=C2

Isomeric SMILES

C1C[NH2+]C[C@H]1COCCCC2=CC=CC=C2

InChI

InChI=1S/C14H21NO/c1-2-5-13(6-3-1)7-4-10-16-12-14-8-9-15-11-14/h1-3,5-6,14-15H,4,7-12H2/p+1/t14-/m0/s1