N-(4,5-dimethoxy-2-methyl-phenyl)-4-(morpholin-4-ium-4-ylmethyl)benzamide

Systemtic Name: N-(4,5-dimethoxy-2-methyl-phenyl)-4-(morpholin-4-ium-4-ylmethyl)benzamide Openeye Name: N-(4,5-dimethoxy-2-methyl-phenyl)-4-(morpholin-4-ium-4-ylmethyl)benzamide CAS Name: N-(4,5-dimethoxy-2-methylphenyl)-4-(4-morpholin-4-iumylmethyl)benzamide IUPAC Name: N-(4,5-dimethoxy-2-methylphenyl)-4-(morpholin-4-ium-4-ylmethyl)benzamide Traditional Name: N-(4,5-dimethoxy-2-methyl-phenyl)-4-(morpholin-4-ium-4-ylmethyl)benzamide Formula: C21H27N2O4+ MolecularWeight: 371.45008

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1NC(=O)C2=CC=C(C=C2)C[NH+]3CCOCC3)OC)OC

Isomeric SMILES

CC1=CC(=C(C=C1NC(=O)C2=CC=C(C=C2)C[NH+]3CCOCC3)OC)OC

InChI

InChI=1S/C21H26N2O4/c1-15-12-19(25-2)20(26-3)13-18(15)22-21(24)17-6-4-16(5-7-17)14-23-8-10-27-11-9-23/h4-7,12-13H,8-11,14H2,1-3H3,(H,22,24)/p+1