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(2R)-2-(1H-indol-3-yl)-2-[4-(phenylmethyl)piperazin-1-ium-1-yl]ethanoate
(2R)-2-(1H-indol-3-yl)-2-[4-(phenylmethyl)piperazin-1-ium-1-yl]ethanoate
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Descriptors Computed from Structure
Canonical SMILES:
C1CN(CC[NH+]1C(C2=CNC3=CC=CC=C32)C(=O)[O-])CC4=CC=CC=C4
Isomeric SMILES
C1CN(CC[NH+]1[C@H](C2=CNC3=CC=CC=C32)C(=O)[O-])CC4=CC=CC=C4
InChI
InChI=1S/C21H23N3O2/c25-21(26)20(18-14-22-19-9-5-4-8-17(18)19)24-12-10-23(11-13-24)15-16-6-2-1-3-7-16/h1-9,14,20,22H,10-13,15H2,(H,25,26)/t20-/m1/s1
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