[4-[(2-methoxynaphthalen-1-yl)methyl]piperazin-4-ium-1-yl]-pyridin-3-yl-methanone

Systemtic Name: [4-[(2-methoxynaphthalen-1-yl)methyl]piperazin-4-ium-1-yl]-pyridin-3-yl-methanone Openeye Name: [4-[(2-methoxy-1-naphthyl)methyl]piperazin-4-ium-1-yl]-(3-pyridyl)methanone CAS Name: [4-[(2-methoxy-1-naphthalenyl)methyl]-1-piperazin-4-iumyl]-(3-pyridinyl)methanone IUPAC Name: [4-[(2-methoxynaphthalen-1-yl)methyl]piperazin-4-ium-1-yl]-pyridin-3-ylmethanone Traditional Name: [4-[(2-methoxy-1-naphthyl)methyl]piperazin-4-ium-1-yl]-(3-pyridyl)methanone Formula: C22H24N3O2+ MolecularWeight: 362.44486

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=CC=CC=C2C=C1)C[NH+]3CCN(CC3)C(=O)C4=CN=CC=C4

Isomeric SMILES

COC1=C(C2=CC=CC=C2C=C1)C[NH+]3CCN(CC3)C(=O)C4=CN=CC=C4

InChI

InChI=1S/C22H23N3O2/c1-27-21-9-8-17-5-2-3-7-19(17)20(21)16-24-11-13-25(14-12-24)22(26)18-6-4-10-23-15-18/h2-10,15H,11-14,16H2,1H3/p+1