2-(2,4-dimethylphenyl)-5-(5-methylfuran-2-yl)-N-(2-morpholin-4-ium-4-ylethyl)pyrazole-3-carboxamide

Systemtic Name: 2-(2,4-dimethylphenyl)-5-(5-methylfuran-2-yl)-N-(2-morpholin-4-ium-4-ylethyl)pyrazole-3-carboxamide Openeye Name: 2-(2,4-dimethylphenyl)-5-(5-methyl-2-furyl)-N-(2-morpholin-4-ium-4-ylethyl)pyrazole-3-carboxamide CAS Name: 2-(2,4-dimethylphenyl)-5-(5-methyl-2-furanyl)-N-[2-(4-morpholin-4-iumyl)ethyl]-3-pyrazolecarboxamide IUPAC Name: 2-(2,4-dimethylphenyl)-5-(5-methylfuran-2-yl)-N-(2-morpholin-4-ium-4-ylethyl)pyrazole-3-carboxamide Traditional Name: 2-(2,4-dimethylphenyl)-5-(5-methyl-2-furyl)-N-(2-morpholin-4-ium-4-ylethyl)pyrazole-3-carboxamide Formula: C23H29N4O3+ MolecularWeight: 409.50136

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2C(=CC(=N2)C3=CC=C(O3)C)C(=O)NCC[NH+]4CCOCC4)C

Isomeric SMILES

CC1=CC(=C(C=C1)N2C(=CC(=N2)C3=CC=C(O3)C)C(=O)NCC[NH+]4CCOCC4)C

InChI

InChI=1S/C23H28N4O3/c1-16-4-6-20(17(2)14-16)27-21(15-19(25-27)22-7-5-18(3)30-22)23(28)24-8-9-26-10-12-29-13-11-26/h4-7,14-15H,8-13H2,1-3H3,(H,24,28)/p+1