[(3S)-3-(diethylamino)-1-(phenylmethyl)pyrrolidin-1-ium-3-yl]methylazanium

Systemtic Name: [(3S)-3-(diethylamino)-1-(phenylmethyl)pyrrolidin-1-ium-3-yl]methylazanium Openeye Name: [(3S)-1-benzyl-3-(diethylamino)pyrrolidin-1-ium-3-yl]methylammonium CAS Name: [(3S)-3-(diethylamino)-1-(phenylmethyl)-3-pyrrolidin-1-iumyl]methylammonium IUPAC Name: [(3S)-1-benzyl-3-(diethylamino)pyrrolidin-1-ium-3-yl]methylazanium Traditional Name: [(3S)-1-benzyl-3-(diethylamino)pyrrolidin-1-ium-3-yl]methylammonium Formula: C16H29N3+2 MolecularWeight: 263.42156

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1(CC[NH+](C1)CC2=CC=CC=C2)C[NH3+]

Isomeric SMILES

CCN(CC)[C@@]1(CC[NH+](C1)CC2=CC=CC=C2)C[NH3+]

InChI

InChI=1S/C16H27N3/c1-3-19(4-2)16(13-17)10-11-18(14-16)12-15-8-6-5-7-9-15/h5-9H,3-4,10-14,17H2,1-2H3/p+2/t16-/m0/s1