1-[(1-ethylpyrazol-4-yl)methyl]-N-[3-(1H-indol-2-yl)phenyl]piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[(1-ethylpyrazol-4-yl)methyl]-N-[3-(1H-indol-2-yl)phenyl]piperidin-1-ium-4-carboxamide Openeye Name: 1-[(1-ethylpyrazol-4-yl)methyl]-N-[3-(1H-indol-2-yl)phenyl]piperidin-1-ium-4-carboxamide CAS Name: 1-[(1-ethyl-4-pyrazolyl)methyl]-N-[3-(1H-indol-2-yl)phenyl]-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[(1-ethylpyrazol-4-yl)methyl]-N-[3-(1H-indol-2-yl)phenyl]piperidin-1-ium-4-carboxamide Traditional Name: 1-[(1-ethylpyrazol-4-yl)methyl]-N-[3-(1H-indol-2-yl)phenyl]piperidin-1-ium-4-carboxamide Formula: C26H30N5O+ MolecularWeight: 428.5493

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C=N1)C[NH+]2CCC(CC2)C(=O)NC3=CC=CC(=C3)C4=CC5=CC=CC=C5N4

Isomeric SMILES

CCN1C=C(C=N1)C[NH+]2CCC(CC2)C(=O)NC3=CC=CC(=C3)C4=CC5=CC=CC=C5N4

InChI

InChI=1S/C26H29N5O/c1-2-31-18-19(16-27-31)17-30-12-10-20(11-13-30)26(32)28-23-8-5-7-21(14-23)25-15-22-6-3-4-9-24(22)29-25/h3-9,14-16,18,20,29H,2,10-13,17H2,1H3,(H,28,32)/p+1