4-(2,3-dimethylphenyl)-N-(2-methyl-2-morpholin-4-ium-4-yl-propyl)piperazine-1-carboxamide

Systemtic Name: 4-(2,3-dimethylphenyl)-N-(2-methyl-2-morpholin-4-ium-4-yl-propyl)piperazine-1-carboxamide Openeye Name: 4-(2,3-dimethylphenyl)-N-(2-methyl-2-morpholin-4-ium-4-yl-propyl)piperazine-1-carboxamide CAS Name: 4-(2,3-dimethylphenyl)-N-[2-methyl-2-(4-morpholin-4-iumyl)propyl]-1-piperazinecarboxamide IUPAC Name: 4-(2,3-dimethylphenyl)-N-(2-methyl-2-morpholin-4-ium-4-ylpropyl)piperazine-1-carboxamide Traditional Name: 4-(2,3-dimethylphenyl)-N-(2-methyl-2-morpholin-4-ium-4-yl-propyl)piperazine-1-carboxamide Formula: C21H35N4O2+ MolecularWeight: 375.5282

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)NCC(C)(C)[NH+]3CCOCC3)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)NCC(C)(C)[NH+]3CCOCC3)C

InChI

InChI=1S/C21H34N4O2/c1-17-6-5-7-19(18(17)2)23-8-10-24(11-9-23)20(26)22-16-21(3,4)25-12-14-27-15-13-25/h5-7H,8-16H2,1-4H3,(H,22,26)/p+1