1-[(2R)-2-oxidanyl-3-pyrrolidin-1-ium-1-yl-propyl]indole-3-carbaldehyde

Systemtic Name: 1-[(2R)-2-oxidanyl-3-pyrrolidin-1-ium-1-yl-propyl]indole-3-carbaldehyde Openeye Name: 1-[(2R)-2-hydroxy-3-pyrrolidin-1-ium-1-yl-propyl]indole-3-carbaldehyde CAS Name: 1-[(2R)-2-hydroxy-3-(1-pyrrolidin-1-iumyl)propyl]-3-indolecarboxaldehyde IUPAC Name: 1-[(2R)-2-hydroxy-3-pyrrolidin-1-ium-1-ylpropyl]indole-3-carbaldehyde Traditional Name: 1-[(2R)-2-hydroxy-3-pyrrolidin-1-ium-1-yl-propyl]indole-3-carbaldehyde Formula: C16H21N2O2+ MolecularWeight: 273.35014

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CC(CN2C=C(C3=CC=CC=C32)C=O)O

Isomeric SMILES

C1CC[NH+](C1)C[C@@H](CN2C=C(C3=CC=CC=C32)C=O)O

InChI

InChI=1S/C16H20N2O2/c19-12-13-9-18(16-6-2-1-5-15(13)16)11-14(20)10-17-7-3-4-8-17/h1-2,5-6,9,12,14,20H,3-4,7-8,10-11H2/p+1/t14-/m0/s1