[(2S)-1-carbazol-9-yl-3-pyrrolidin-1-ium-1-yl-propan-2-yl] ethanoate

Systemtic Name: [(2S)-1-carbazol-9-yl-3-pyrrolidin-1-ium-1-yl-propan-2-yl] ethanoate Openeye Name: [(1S)-1-(carbazol-9-ylmethyl)-2-pyrrolidin-1-ium-1-yl-ethyl] acetate CAS Name: acetic acid [(2S)-1-(9-carbazolyl)-3-(1-pyrrolidin-1-iumyl)propan-2-yl] ester IUPAC Name: [(2S)-1-carbazol-9-yl-3-pyrrolidin-1-ium-1-ylpropan-2-yl] acetate Traditional Name: acetic acid [(1S)-1-(carbazol-9-ylmethyl)-2-pyrrolidin-1-ium-1-yl-ethyl] ester Formula: C21H25N2O2+ MolecularWeight: 337.4354

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(C[NH+]1CCCC1)CN2C3=CC=CC=C3C4=CC=CC=C42

Isomeric SMILES

CC(=O)O[C@H](C[NH+]1CCCC1)CN2C3=CC=CC=C3C4=CC=CC=C42

InChI

InChI=1S/C21H24N2O2/c1-16(24)25-17(14-22-12-6-7-13-22)15-23-20-10-4-2-8-18(20)19-9-3-5-11-21(19)23/h2-5,8-11,17H,6-7,12-15H2,1H3/p+1/t17-/m1/s1