2-[4-[(4-chloranyl-1-oxidanyl-naphthalen-2-yl)methyl]piperazin-1-ium-1-yl]-N-cyclopropyl-ethanamide

Systemtic Name: 2-[4-[(4-chloranyl-1-oxidanyl-naphthalen-2-yl)methyl]piperazin-1-ium-1-yl]-N-cyclopropyl-ethanamide Openeye Name: 2-[4-[(4-chloro-1-hydroxy-2-naphthyl)methyl]piperazin-1-ium-1-yl]-N-cyclopropyl-acetamide CAS Name: 2-[4-[(4-chloro-1-hydroxy-2-naphthalenyl)methyl]-1-piperazin-1-iumyl]-N-cyclopropylacetamide IUPAC Name: 2-[4-[(4-chloro-1-hydroxynaphthalen-2-yl)methyl]piperazin-1-ium-1-yl]-N-cyclopropylacetamide Traditional Name: 2-[4-[(4-chloro-1-hydroxy-2-naphthyl)methyl]piperazin-1-ium-1-yl]-N-cyclopropyl-acetamide Formula: C20H25ClN3O2+ MolecularWeight: 374.8844

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C[NH+]2CCN(CC2)CC3=C(C4=CC=CC=C4C(=C3)Cl)O

Isomeric SMILES

C1CC1NC(=O)C[NH+]2CCN(CC2)CC3=C(C4=CC=CC=C4C(=C3)Cl)O

InChI

InChI=1S/C20H24ClN3O2/c21-18-11-14(20(26)17-4-2-1-3-16(17)18)12-23-7-9-24(10-8-23)13-19(25)22-15-5-6-15/h1-4,11,15,26H,5-10,12-13H2,(H,22,25)/p+1