N-[(2,5-dimethylpyrazol-3-yl)methyl]-N-(2-morpholin-4-ium-4-ylethyl)-5-phenyl-1,3-oxazole-4-carboxamide

Systemtic Name: N-[(2,5-dimethylpyrazol-3-yl)methyl]-N-(2-morpholin-4-ium-4-ylethyl)-5-phenyl-1,3-oxazole-4-carboxamide Openeye Name: N-[(2,5-dimethylpyrazol-3-yl)methyl]-N-(2-morpholin-4-ium-4-ylethyl)-5-phenyl-oxazole-4-carboxamide CAS Name: N-[(2,5-dimethyl-3-pyrazolyl)methyl]-N-[2-(4-morpholin-4-iumyl)ethyl]-5-phenyl-4-oxazolecarboxamide IUPAC Name: N-[(2,5-dimethylpyrazol-3-yl)methyl]-N-(2-morpholin-4-ium-4-ylethyl)-5-phenyl-1,3-oxazole-4-carboxamide Traditional Name: N-[(2,5-dimethylpyrazol-3-yl)methyl]-N-(2-morpholin-4-ium-4-ylethyl)-5-phenyl-oxazole-4-carboxamide Formula: C22H28N5O3+ MolecularWeight: 410.48942

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)CN(CC[NH+]2CCOCC2)C(=O)C3=C(OC=N3)C4=CC=CC=C4)C

Isomeric SMILES

CC1=NN(C(=C1)CN(CC[NH+]2CCOCC2)C(=O)C3=C(OC=N3)C4=CC=CC=C4)C

InChI

InChI=1S/C22H27N5O3/c1-17-14-19(25(2)24-17)15-27(9-8-26-10-12-29-13-11-26)22(28)20-21(30-16-23-20)18-6-4-3-5-7-18/h3-7,14,16H,8-13,15H2,1-2H3/p+1