1-oxidanidyl-N-[4-(4-phenylmethoxyphenoxy)butyl]pyridin-1-ium-3-carboxamide

Systemtic Name: 1-oxidanidyl-N-[4-(4-phenylmethoxyphenoxy)butyl]pyridin-1-ium-3-carboxamide Openeye Name: N-[4-(4-benzyloxyphenoxy)butyl]-1-oxido-pyridin-1-ium-3-carboxamide CAS Name: 1-oxido-N-[4-(4-phenylmethoxyphenoxy)butyl]-3-pyridin-1-iumcarboxamide IUPAC Name: 1-oxido-N-[4-(4-phenylmethoxyphenoxy)butyl]pyridin-1-ium-3-carboxamide Traditional Name: N-[4-(4-benzoxyphenoxy)butyl]-1-oxido-pyridin-1-ium-3-carboxamide Formula: C23H24N2O4 MolecularWeight: 392.44766

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=C(C=C2)OCCCCNC(=O)C3=C[N+](=CC=C3)[O-]

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=C(C=C2)OCCCCNC(=O)C3=C[N+](=CC=C3)[O-]

InChI

InChI=1S/C23H24N2O4/c26-23(20-9-6-15-25(27)17-20)24-14-4-5-16-28-21-10-12-22(13-11-21)29-18-19-7-2-1-3-8-19/h1-3,6-13,15,17H,4-5,14,16,18H2,(H,24,26)