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

Systemtic Name: 3-chloranyl-N-[4-(morpholin-4-ium-4-ylmethyl)phenyl]-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-[4-(morpholin-4-ium-4-ylmethyl)phenyl]benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[4-(4-morpholin-4-iumylmethyl)phenyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-[4-(morpholin-4-ium-4-ylmethyl)phenyl]-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-[4-(morpholin-4-ium-4-ylmethyl)phenyl]benzothiophene-2-carboxamide Formula: C20H20ClN2O2S+ MolecularWeight: 387.903

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CC2=CC=C(C=C2)NC(=O)C3=C(C4=CC=CC=C4S3)Cl

Isomeric SMILES

C1COCC[NH+]1CC2=CC=C(C=C2)NC(=O)C3=C(C4=CC=CC=C4S3)Cl

InChI

InChI=1S/C20H19ClN2O2S/c21-18-16-3-1-2-4-17(16)26-19(18)20(24)22-15-7-5-14(6-8-15)13-23-9-11-25-12-10-23/h1-8H,9-13H2,(H,22,24)/p+1