3-methyl-N-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]-1-benzothiophene-2-carboxamide

Systemtic Name: 3-methyl-N-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]-1-benzothiophene-2-carboxamide Openeye Name: 3-methyl-N-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]benzothiophene-2-carboxamide CAS Name: 3-methyl-N-[[2-(4-morpholin-4-iumylmethyl)phenyl]methyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3-methyl-N-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]-1-benzothiophene-2-carboxamide Traditional Name: 3-methyl-N-[2-(morpholin-4-ium-4-ylmethyl)benzyl]benzothiophene-2-carboxamide Formula: C22H25N2O2S+ MolecularWeight: 381.5111

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=CC=CC=C12)C(=O)NCC3=CC=CC=C3C[NH+]4CCOCC4

Isomeric SMILES

CC1=C(SC2=CC=CC=C12)C(=O)NCC3=CC=CC=C3C[NH+]4CCOCC4

InChI

InChI=1S/C22H24N2O2S/c1-16-19-8-4-5-9-20(19)27-21(16)22(25)23-14-17-6-2-3-7-18(17)15-24-10-12-26-13-11-24/h2-9H,10-15H2,1H3,(H,23,25)/p+1