(4-tert-butylphenyl)-[(2S)-1-oxidanylidene-1-pyrrolidin-1-yl-propan-2-yl]azanium

Systemtic Name: (4-tert-butylphenyl)-[(2S)-1-oxidanylidene-1-pyrrolidin-1-yl-propan-2-yl]azanium Openeye Name: (4-tert-butylphenyl)-[(1S)-1-methyl-2-oxo-2-pyrrolidin-1-yl-ethyl]ammonium CAS Name: (4-tert-butylphenyl)-[(2S)-1-oxo-1-(1-pyrrolidinyl)propan-2-yl]ammonium IUPAC Name: (4-tert-butylphenyl)-[(2S)-1-oxo-1-pyrrolidin-1-ylpropan-2-yl]azanium Traditional Name: (4-tert-butylphenyl)-[(1S)-2-keto-1-methyl-2-pyrrolidino-ethyl]ammonium Formula: C17H27N2O+ MolecularWeight: 275.40908

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCCC1)[NH2+]C2=CC=C(C=C2)C(C)(C)C

Isomeric SMILES

C[C@@H](C(=O)N1CCCC1)[NH2+]C2=CC=C(C=C2)C(C)(C)C

InChI

InChI=1S/C17H26N2O/c1-13(16(20)19-11-5-6-12-19)18-15-9-7-14(8-10-15)17(2,3)4/h7-10,13,18H,5-6,11-12H2,1-4H3/p+1/t13-/m0/s1