[(4S)-4-(4-tert-butylphenyl)-4-pyrrolidin-1-ium-1-yl-butyl]azanium

Systemtic Name: [(4S)-4-(4-tert-butylphenyl)-4-pyrrolidin-1-ium-1-yl-butyl]azanium Openeye Name: [(4S)-4-(4-tert-butylphenyl)-4-pyrrolidin-1-ium-1-yl-butyl]ammonium CAS Name: [(4S)-4-(4-tert-butylphenyl)-4-(1-pyrrolidin-1-iumyl)butyl]ammonium IUPAC Name: [(4S)-4-(4-tert-butylphenyl)-4-pyrrolidin-1-ium-1-ylbutyl]azanium Traditional Name: [(4S)-4-(4-tert-butylphenyl)-4-pyrrolidin-1-ium-1-yl-butyl]ammonium Formula: C18H32N2+2 MolecularWeight: 276.46008

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(CCC[NH3+])[NH+]2CCCC2

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)[C@H](CCC[NH3+])[NH+]2CCCC2

InChI

InChI=1S/C18H30N2/c1-18(2,3)16-10-8-15(9-11-16)17(7-6-12-19)20-13-4-5-14-20/h8-11,17H,4-7,12-14,19H2,1-3H3/p+2/t17-/m0/s1