2-(4-ethylpiperazin-1-ium-1-yl)-N-[(2S)-4-pyrazol-1-ylbutan-2-yl]-1,3-dihydroindene-2-carboxamide

Systemtic Name: 2-(4-ethylpiperazin-1-ium-1-yl)-N-[(2S)-4-pyrazol-1-ylbutan-2-yl]-1,3-dihydroindene-2-carboxamide Openeye Name: 2-(4-ethylpiperazin-1-ium-1-yl)-N-[(1S)-1-methyl-3-pyrazol-1-yl-propyl]indane-2-carboxamide CAS Name: 2-(4-ethyl-1-piperazin-1-iumyl)-N-[(2S)-4-(1-pyrazolyl)butan-2-yl]-1,3-dihydroindene-2-carboxamide IUPAC Name: 2-(4-ethylpiperazin-1-ium-1-yl)-N-[(2S)-4-pyrazol-1-ylbutan-2-yl]-1,3-dihydroindene-2-carboxamide Traditional Name: 2-(4-ethylpiperazin-1-ium-1-yl)-N-[(1S)-1-methyl-3-pyrazol-1-yl-propyl]indane-2-carboxamide Formula: C23H34N5O+ MolecularWeight: 396.54896

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CC[NH+](CC1)C2(CC3=CC=CC=C3C2)C(=O)NC(C)CCN4C=CC=N4

Isomeric SMILES

CCN1CC[NH+](CC1)C2(CC3=CC=CC=C3C2)C(=O)N[C@@H](C)CCN4C=CC=N4

InChI

InChI=1S/C23H33N5O/c1-3-26-13-15-27(16-14-26)23(17-20-7-4-5-8-21(20)18-23)22(29)25-19(2)9-12-28-11-6-10-24-28/h4-8,10-11,19H,3,9,12-18H2,1-2H3,(H,25,29)/p+1/t19-/m0/s1