2-[4-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)piperazin-4-ium-1-yl]-N-phenyl-N-(phenylmethyl)ethanamide

Systemtic Name: 2-[4-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)piperazin-4-ium-1-yl]-N-phenyl-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-[4-(2-oxo-2-pyrrolidin-1-yl-ethyl)piperazin-4-ium-1-yl]-N-phenyl-acetamide CAS Name: 2-[4-[2-oxo-2-(1-pyrrolidinyl)ethyl]-1-piperazin-4-iumyl]-N-phenyl-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-[4-(2-oxo-2-pyrrolidin-1-ylethyl)piperazin-4-ium-1-yl]-N-phenylacetamide Traditional Name: N-benzyl-2-[4-(2-keto-2-pyrrolidino-ethyl)piperazin-4-ium-1-yl]-N-phenyl-acetamide Formula: C25H33N4O2+ MolecularWeight: 421.55512

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C[NH+]2CCN(CC2)CC(=O)N(CC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1CCN(C1)C(=O)C[NH+]2CCN(CC2)CC(=O)N(CC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H32N4O2/c30-24(28-13-7-8-14-28)20-26-15-17-27(18-16-26)21-25(31)29(23-11-5-2-6-12-23)19-22-9-3-1-4-10-22/h1-6,9-12H,7-8,13-21H2/p+1