N-[4-(cyanomethyl)phenyl]-4-(morpholin-4-ium-4-ylmethyl)benzamide

Systemtic Name: N-[4-(cyanomethyl)phenyl]-4-(morpholin-4-ium-4-ylmethyl)benzamide Openeye Name: N-[4-(cyanomethyl)phenyl]-4-(morpholin-4-ium-4-ylmethyl)benzamide CAS Name: N-[4-(cyanomethyl)phenyl]-4-(4-morpholin-4-iumylmethyl)benzamide IUPAC Name: N-[4-(cyanomethyl)phenyl]-4-(morpholin-4-ium-4-ylmethyl)benzamide Traditional Name: N-[4-(cyanomethyl)phenyl]-4-(morpholin-4-ium-4-ylmethyl)benzamide Formula: C20H22N3O2+ MolecularWeight: 336.40758

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CC2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)CC#N

Isomeric SMILES

C1COCC[NH+]1CC2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)CC#N

InChI

InChI=1S/C20H21N3O2/c21-10-9-16-3-7-19(8-4-16)22-20(24)18-5-1-17(2-6-18)15-23-11-13-25-14-12-23/h1-8H,9,11-15H2,(H,22,24)/p+1