morpholin-4-yl-[3-oxidanyl-4-[(4-pyridin-1-ium-2-ylpiperazin-1-ium-1-yl)methyl]naphthalen-2-yl]methanone

Systemtic Name: morpholin-4-yl-[3-oxidanyl-4-[(4-pyridin-1-ium-2-ylpiperazin-1-ium-1-yl)methyl]naphthalen-2-yl]methanone Openeye Name: [3-hydroxy-4-[(4-pyridin-1-ium-2-ylpiperazin-1-ium-1-yl)methyl]-2-naphthyl]-morpholino-methanone CAS Name: [3-hydroxy-4-[[4-(2-pyridin-1-iumyl)-1-piperazin-1-iumyl]methyl]-2-naphthalenyl]-(4-morpholinyl)methanone IUPAC Name: [3-hydroxy-4-[(4-pyridin-1-ium-2-ylpiperazin-1-ium-1-yl)methyl]naphthalen-2-yl]-morpholin-4-ylmethanone Traditional Name: [3-hydroxy-4-[(4-pyridin-1-ium-2-ylpiperazin-1-ium-1-yl)methyl]-2-naphthyl]-morpholino-methanone Formula: C25H30N4O3+2 MolecularWeight: 434.5307

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=C(C(=CC3=CC=CC=C32)C(=O)N4CCOCC4)O)C5=CC=CC=[NH+]5

Isomeric SMILES

C1CN(CC[NH+]1CC2=C(C(=CC3=CC=CC=C32)C(=O)N4CCOCC4)O)C5=CC=CC=[NH+]5

InChI

InChI=1S/C25H28N4O3/c30-24-21(25(31)29-13-15-32-16-14-29)17-19-5-1-2-6-20(19)22(24)18-27-9-11-28(12-10-27)23-7-3-4-8-26-23/h1-8,17,30H,9-16,18H2/p+2