2-[(2R)-1-[(3-methoxyphenyl)methyl]-3-oxidanylidene-piperazin-1-ium-2-yl]-N-[(5-methylpyrazin-2-yl)methyl]ethanamide

Systemtic Name: 2-[(2R)-1-[(3-methoxyphenyl)methyl]-3-oxidanylidene-piperazin-1-ium-2-yl]-N-[(5-methylpyrazin-2-yl)methyl]ethanamide Openeye Name: 2-[(2R)-1-[(3-methoxyphenyl)methyl]-3-oxo-piperazin-1-ium-2-yl]-N-[(5-methylpyrazin-2-yl)methyl]acetamide CAS Name: 2-[(2R)-1-[(3-methoxyphenyl)methyl]-3-oxo-2-piperazin-1-iumyl]-N-[(5-methyl-2-pyrazinyl)methyl]acetamide IUPAC Name: 2-[(2R)-1-[(3-methoxyphenyl)methyl]-3-oxopiperazin-1-ium-2-yl]-N-[(5-methylpyrazin-2-yl)methyl]acetamide Traditional Name: 2-[(2R)-3-keto-1-m-anisyl-piperazin-1-ium-2-yl]-N-[(5-methylpyrazin-2-yl)methyl]acetamide Formula: C20H26N5O3+ MolecularWeight: 384.45214

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(C=N1)CNC(=O)CC2C(=O)NCC[NH+]2CC3=CC(=CC=C3)OC

Isomeric SMILES

CC1=CN=C(C=N1)CNC(=O)C[C@@H]2C(=O)NCC[NH+]2CC3=CC(=CC=C3)OC

InChI

InChI=1S/C20H25N5O3/c1-14-10-23-16(11-22-14)12-24-19(26)9-18-20(27)21-6-7-25(18)13-15-4-3-5-17(8-15)28-2/h3-5,8,10-11,18H,6-7,9,12-13H2,1-2H3,(H,21,27)(H,24,26)/p+1/t18-/m1/s1