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

Systemtic Name: 2-[(2R)-1-[(3-methoxyphenyl)methyl]-3-oxidanylidene-piperazin-1-ium-2-yl]-N-prop-2-enyl-ethanamide Openeye Name: N-allyl-2-[(2R)-1-[(3-methoxyphenyl)methyl]-3-oxo-piperazin-1-ium-2-yl]acetamide CAS Name: 2-[(2R)-1-[(3-methoxyphenyl)methyl]-3-oxo-2-piperazin-1-iumyl]-N-prop-2-enylacetamide IUPAC Name: 2-[(2R)-1-[(3-methoxyphenyl)methyl]-3-oxopiperazin-1-ium-2-yl]-N-prop-2-enylacetamide Traditional Name: N-allyl-2-[(2R)-3-keto-1-m-anisyl-piperazin-1-ium-2-yl]acetamide Formula: C17H24N3O3+ MolecularWeight: 318.39076

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C[NH+]2CCNC(=O)C2CC(=O)NCC=C

Isomeric SMILES

COC1=CC=CC(=C1)C[NH+]2CCNC(=O)[C@H]2CC(=O)NCC=C

InChI

InChI=1S/C17H23N3O3/c1-3-7-18-16(21)11-15-17(22)19-8-9-20(15)12-13-5-4-6-14(10-13)23-2/h3-6,10,15H,1,7-9,11-12H2,2H3,(H,18,21)(H,19,22)/p+1/t15-/m1/s1