2-[(2R)-1-(naphthalen-2-ylmethyl)-3-oxidanylidene-piperazin-1-ium-2-yl]-N-(oxan-4-yl)ethanamide

Systemtic Name: 2-[(2R)-1-(naphthalen-2-ylmethyl)-3-oxidanylidene-piperazin-1-ium-2-yl]-N-(oxan-4-yl)ethanamide Openeye Name: 2-[(2R)-1-(2-naphthylmethyl)-3-oxo-piperazin-1-ium-2-yl]-N-tetrahydropyran-4-yl-acetamide CAS Name: 2-[(2R)-1-(2-naphthalenylmethyl)-3-oxo-2-piperazin-1-iumyl]-N-(4-oxanyl)acetamide IUPAC Name: 2-[(2R)-1-(naphthalen-2-ylmethyl)-3-oxopiperazin-1-ium-2-yl]-N-(oxan-4-yl)acetamide Traditional Name: 2-[(2R)-3-keto-1-(2-naphthylmethyl)piperazin-1-ium-2-yl]-N-tetrahydropyran-4-yl-acetamide Formula: C22H28N3O3+ MolecularWeight: 382.47602

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCC1NC(=O)CC2C(=O)NCC[NH+]2CC3=CC4=CC=CC=C4C=C3

Isomeric SMILES

C1COCCC1NC(=O)C[C@@H]2C(=O)NCC[NH+]2CC3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C22H27N3O3/c26-21(24-19-7-11-28-12-8-19)14-20-22(27)23-9-10-25(20)15-16-5-6-17-3-1-2-4-18(17)13-16/h1-6,13,19-20H,7-12,14-15H2,(H,23,27)(H,24,26)/p+1/t20-/m1/s1