N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]-3-oxidanyl-naphthalene-2-carboxamide

Systemtic Name: N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]-3-oxidanyl-naphthalene-2-carboxamide Openeye Name: 3-hydroxy-N-[(6-morpholinopyridin-1-ium-3-yl)methyl]naphthalene-2-carboxamide CAS Name: 3-hydroxy-N-[[6-(4-morpholinyl)-3-pyridin-1-iumyl]methyl]-2-naphthalenecarboxamide IUPAC Name: 3-hydroxy-N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]naphthalene-2-carboxamide Traditional Name: 3-hydroxy-N-[(6-morpholinopyridin-1-ium-3-yl)methyl]-2-naphthamide Formula: C21H22N3O3+ MolecularWeight: 364.41768

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=[NH+]C=C(C=C2)CNC(=O)C3=CC4=CC=CC=C4C=C3O

Isomeric SMILES

C1COCCN1C2=[NH+]C=C(C=C2)CNC(=O)C3=CC4=CC=CC=C4C=C3O

InChI

InChI=1S/C21H21N3O3/c25-19-12-17-4-2-1-3-16(17)11-18(19)21(26)23-14-15-5-6-20(22-13-15)24-7-9-27-10-8-24/h1-6,11-13,25H,7-10,14H2,(H,23,26)/p+1