5-(4-methoxyphenyl)-2-(3-methylphenyl)-N-(2-morpholin-4-ium-4-ylethyl)pyrazole-3-carboxamide

Systemtic Name: 5-(4-methoxyphenyl)-2-(3-methylphenyl)-N-(2-morpholin-4-ium-4-ylethyl)pyrazole-3-carboxamide Openeye Name: 5-(4-methoxyphenyl)-N-(2-morpholin-4-ium-4-ylethyl)-2-(m-tolyl)pyrazole-3-carboxamide CAS Name: 5-(4-methoxyphenyl)-2-(3-methylphenyl)-N-[2-(4-morpholin-4-iumyl)ethyl]-3-pyrazolecarboxamide IUPAC Name: 5-(4-methoxyphenyl)-2-(3-methylphenyl)-N-(2-morpholin-4-ium-4-ylethyl)pyrazole-3-carboxamide Traditional Name: 5-(4-methoxyphenyl)-N-(2-morpholin-4-ium-4-ylethyl)-2-(m-tolyl)pyrazole-3-carboxamide Formula: C24H29N4O3+ MolecularWeight: 421.51206

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H28N4O3/c1-18-4-3-5-20(16-18)28-23(24(29)25-10-11-27-12-14-31-15-13-27)17-22(26-28)19-6-8-21(30-2)9-7-19/h3-9,16-17H,10-15H2,1-2H3,(H,25,29)/p+1