4-(morpholin-4-ium-4-ylmethyl)-N-(2,4,6-trimethylphenyl)benzamide

Systemtic Name: 4-(morpholin-4-ium-4-ylmethyl)-N-(2,4,6-trimethylphenyl)benzamide Openeye Name: 4-(morpholin-4-ium-4-ylmethyl)-N-(2,4,6-trimethylphenyl)benzamide CAS Name: 4-(4-morpholin-4-iumylmethyl)-N-(2,4,6-trimethylphenyl)benzamide IUPAC Name: 4-(morpholin-4-ium-4-ylmethyl)-N-(2,4,6-trimethylphenyl)benzamide Traditional Name: N-mesityl-4-(morpholin-4-ium-4-ylmethyl)benzamide Formula: C21H27N2O2+ MolecularWeight: 339.45128

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)NC(=O)C2=CC=C(C=C2)C[NH+]3CCOCC3)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NC(=O)C2=CC=C(C=C2)C[NH+]3CCOCC3)C

InChI

InChI=1S/C21H26N2O2/c1-15-12-16(2)20(17(3)13-15)22-21(24)19-6-4-18(5-7-19)14-23-8-10-25-11-9-23/h4-7,12-13H,8-11,14H2,1-3H3,(H,22,24)/p+1