[4-(naphthalen-2-ylmethyl)piperazin-4-ium-1-yl]-pyridin-4-yl-methanone

Systemtic Name: [4-(naphthalen-2-ylmethyl)piperazin-4-ium-1-yl]-pyridin-4-yl-methanone Openeye Name: [4-(2-naphthylmethyl)piperazin-4-ium-1-yl]-(4-pyridyl)methanone CAS Name: [4-(2-naphthalenylmethyl)-1-piperazin-4-iumyl]-pyridin-4-ylmethanone IUPAC Name: [4-(naphthalen-2-ylmethyl)piperazin-4-ium-1-yl]-pyridin-4-ylmethanone Traditional Name: [4-(2-naphthylmethyl)piperazin-4-ium-1-yl]-(4-pyridyl)methanone Formula: C21H22N3O+ MolecularWeight: 332.41888

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC3=CC=CC=C3C=C2)C(=O)C4=CC=NC=C4

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC3=CC=CC=C3C=C2)C(=O)C4=CC=NC=C4

InChI

InChI=1S/C21H21N3O/c25-21(19-7-9-22-10-8-19)24-13-11-23(12-14-24)16-17-5-6-18-3-1-2-4-20(18)15-17/h1-10,15H,11-14,16H2/p+1