(2-ethoxynaphthalen-1-yl)-(4-pyridin-1-ium-2-ylpiperazin-1-yl)methanone

Systemtic Name: (2-ethoxynaphthalen-1-yl)-(4-pyridin-1-ium-2-ylpiperazin-1-yl)methanone Openeye Name: (2-ethoxy-1-naphthyl)-(4-pyridin-1-ium-2-ylpiperazin-1-yl)methanone CAS Name: (2-ethoxy-1-naphthalenyl)-[4-(2-pyridin-1-iumyl)-1-piperazinyl]methanone IUPAC Name: (2-ethoxynaphthalen-1-yl)-(4-pyridin-1-ium-2-ylpiperazin-1-yl)methanone Traditional Name: (2-ethoxy-1-naphthyl)-(4-pyridin-1-ium-2-ylpiperazino)methanone Formula: C22H24N3O2+ MolecularWeight: 362.44486

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C2=CC=CC=C2C=C1)C(=O)N3CCN(CC3)C4=CC=CC=[NH+]4

Isomeric SMILES

CCOC1=C(C2=CC=CC=C2C=C1)C(=O)N3CCN(CC3)C4=CC=CC=[NH+]4

InChI

InChI=1S/C22H23N3O2/c1-2-27-19-11-10-17-7-3-4-8-18(17)21(19)22(26)25-15-13-24(14-16-25)20-9-5-6-12-23-20/h3-12H,2,13-16H2,1H3/p+1