5-(4-methoxyphenyl)-4-[C-methyl-N-(2-morpholin-4-ium-4-ylethyl)carbonimidoyl]-2-phenyl-4H-pyrazol-3-one

Systemtic Name: 5-(4-methoxyphenyl)-4-[C-methyl-N-(2-morpholin-4-ium-4-ylethyl)carbonimidoyl]-2-phenyl-4H-pyrazol-3-one Openeye Name: 5-(4-methoxyphenyl)-4-[C-methyl-N-(2-morpholin-4-ium-4-ylethyl)carbonimidoyl]-2-phenyl-4H-pyrazol-3-one CAS Name: 5-(4-methoxyphenyl)-4-[1-[2-(4-morpholin-4-iumyl)ethylimino]ethyl]-2-phenyl-4H-pyrazol-3-one IUPAC Name: 5-(4-methoxyphenyl)-4-[C-methyl-N-(2-morpholin-4-ium-4-ylethyl)carbonimidoyl]-2-phenyl-4H-pyrazol-3-one Traditional Name: 5-(4-methoxyphenyl)-4-[C-methyl-N-(2-morpholin-4-ium-4-ylethyl)carbonimidoyl]-2-phenyl-2-pyrazolin-3-one Formula: C24H29N4O3+ MolecularWeight: 421.51206

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NCC[NH+]1CCOCC1)C2C(=NN(C2=O)C3=CC=CC=C3)C4=CC=C(C=C4)OC

Isomeric SMILES

CC(=NCC[NH+]1CCOCC1)C2C(=NN(C2=O)C3=CC=CC=C3)C4=CC=C(C=C4)OC

InChI

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