N-[3-(2-methyl-1H-imidazol-3-ium-3-yl)propyl]-2-[(2R)-3-oxidanylidene-1-(phenylmethyl)piperazin-1-ium-2-yl]ethanamide

Systemtic Name: N-[3-(2-methyl-1H-imidazol-3-ium-3-yl)propyl]-2-[(2R)-3-oxidanylidene-1-(phenylmethyl)piperazin-1-ium-2-yl]ethanamide Openeye Name: 2-[(2R)-1-benzyl-3-oxo-piperazin-1-ium-2-yl]-N-[3-(2-methyl-1H-imidazol-3-ium-3-yl)propyl]acetamide CAS Name: N-[3-(2-methyl-1H-imidazol-3-ium-3-yl)propyl]-2-[(2R)-3-oxo-1-(phenylmethyl)-2-piperazin-1-iumyl]acetamide IUPAC Name: 2-[(2R)-1-benzyl-3-oxopiperazin-1-ium-2-yl]-N-[3-(2-methyl-1H-imidazol-3-ium-3-yl)propyl]acetamide Traditional Name: 2-[(2R)-1-benzyl-3-keto-piperazin-1-ium-2-yl]-N-[3-(2-methyl-1H-imidazol-3-ium-3-yl)propyl]acetamide Formula: C20H29N5O2+2 MolecularWeight: 371.47656

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C=CN1)CCCNC(=O)CC2C(=O)NCC[NH+]2CC3=CC=CC=C3

Isomeric SMILES

CC1=[N+](C=CN1)CCCNC(=O)C[C@@H]2C(=O)NCC[NH+]2CC3=CC=CC=C3

InChI

InChI=1S/C20H27N5O2/c1-16-21-9-12-24(16)11-5-8-22-19(26)14-18-20(27)23-10-13-25(18)15-17-6-3-2-4-7-17/h2-4,6-7,9,12,18H,5,8,10-11,13-15H2,1H3,(H2,22,23,26,27)/p+2/t18-/m1/s1