(2R)-2-(1H-indol-3-yl)-2-(4-methanoylpiperazin-1-ium-1-yl)ethanoate

Systemtic Name: (2R)-2-(1H-indol-3-yl)-2-(4-methanoylpiperazin-1-ium-1-yl)ethanoate Openeye Name: (2R)-2-(4-formylpiperazin-1-ium-1-yl)-2-(1H-indol-3-yl)acetate CAS Name: (2R)-2-(4-formyl-1-piperazin-1-iumyl)-2-(1H-indol-3-yl)acetate IUPAC Name: (2R)-2-(4-formylpiperazin-1-ium-1-yl)-2-(1H-indol-3-yl)acetate Traditional Name: (2R)-2-(4-formylpiperazin-1-ium-1-yl)-2-(1H-indol-3-yl)acetate Formula: C15H17N3O3 MolecularWeight: 287.31378

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1C(C2=CNC3=CC=CC=C32)C(=O)[O-])C=O

Isomeric SMILES

C1CN(CC[NH+]1[C@H](C2=CNC3=CC=CC=C32)C(=O)[O-])C=O

InChI

InChI=1S/C15H17N3O3/c19-10-17-5-7-18(8-6-17)14(15(20)21)12-9-16-13-4-2-1-3-11(12)13/h1-4,9-10,14,16H,5-8H2,(H,20,21)/t14-/m1/s1