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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C[NH+]2CCNC(=O)C2CC(=O)NCCC3=NC=CN=C3

Isomeric SMILES

COC1=CC=CC=C1C[NH+]2CCNC(=O)[C@H]2CC(=O)NCCC3=NC=CN=C3

InChI

InChI=1S/C20H25N5O3/c1-28-18-5-3-2-4-15(18)14-25-11-10-24-20(27)17(25)12-19(26)23-7-6-16-13-21-8-9-22-16/h2-5,8-9,13,17H,6-7,10-12,14H2,1H3,(H,23,26)(H,24,27)/p+1/t17-/m1/s1