2-[4-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]piperazin-4-ium-1-yl]-N-naphthalen-2-yl-ethanamide

Systemtic Name: 2-[4-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]piperazin-4-ium-1-yl]-N-naphthalen-2-yl-ethanamide Openeye Name: 2-[4-[2-(azepan-1-yl)-2-oxo-ethyl]piperazin-4-ium-1-yl]-N-(2-naphthyl)acetamide CAS Name: 2-[4-[2-(1-azepanyl)-2-oxoethyl]-1-piperazin-4-iumyl]-N-(2-naphthalenyl)acetamide IUPAC Name: 2-[4-[2-(azepan-1-yl)-2-oxoethyl]piperazin-4-ium-1-yl]-N-naphthalen-2-ylacetamide Traditional Name: 2-[4-[2-(azepan-1-yl)-2-keto-ethyl]piperazin-4-ium-1-yl]-N-(2-naphthyl)acetamide Formula: C24H33N4O2+ MolecularWeight: 409.54442

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C[NH+]2CCN(CC2)CC(=O)NC3=CC4=CC=CC=C4C=C3

Isomeric SMILES

C1CCCN(CC1)C(=O)C[NH+]2CCN(CC2)CC(=O)NC3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C24H32N4O2/c29-23(25-22-10-9-20-7-3-4-8-21(20)17-22)18-26-13-15-27(16-14-26)19-24(30)28-11-5-1-2-6-12-28/h3-4,7-10,17H,1-2,5-6,11-16,18-19H2,(H,25,29)/p+1