N-[(1-methyl-2,3-dihydroindol-5-yl)methyl]-2-[(2R)-1-(2-methylpropyl)-3-oxidanylidene-piperazin-1-ium-2-yl]ethanamide

Systemtic Name: N-[(1-methyl-2,3-dihydroindol-5-yl)methyl]-2-[(2R)-1-(2-methylpropyl)-3-oxidanylidene-piperazin-1-ium-2-yl]ethanamide Openeye Name: 2-[(2R)-1-isobutyl-3-oxo-piperazin-1-ium-2-yl]-N-[(1-methylindolin-5-yl)methyl]acetamide CAS Name: N-[(1-methyl-2,3-dihydroindol-5-yl)methyl]-2-[(2R)-1-(2-methylpropyl)-3-oxo-2-piperazin-1-iumyl]acetamide IUPAC Name: N-[(1-methyl-2,3-dihydroindol-5-yl)methyl]-2-[(2R)-1-(2-methylpropyl)-3-oxopiperazin-1-ium-2-yl]acetamide Traditional Name: 2-[(2R)-1-isobutyl-3-keto-piperazin-1-ium-2-yl]-N-[(1-methylindolin-5-yl)methyl]acetamide Formula: C20H31N4O2+ MolecularWeight: 359.48574

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C[NH+]1CCNC(=O)C1CC(=O)NCC2=CC3=C(C=C2)N(CC3)C

Isomeric SMILES

CC(C)C[NH+]1CCNC(=O)[C@H]1CC(=O)NCC2=CC3=C(C=C2)N(CC3)C

InChI

InChI=1S/C20H30N4O2/c1-14(2)13-24-9-7-21-20(26)18(24)11-19(25)22-12-15-4-5-17-16(10-15)6-8-23(17)3/h4-5,10,14,18H,6-9,11-13H2,1-3H3,(H,21,26)(H,22,25)/p+1/t18-/m1/s1