N-[3-(4-methylphenyl)propyl]-5-(morpholin-4-ium-4-ylmethyl)-1,2-oxazole-3-carboxamide

Systemtic Name: N-[3-(4-methylphenyl)propyl]-5-(morpholin-4-ium-4-ylmethyl)-1,2-oxazole-3-carboxamide Openeye Name: 5-(morpholin-4-ium-4-ylmethyl)-N-[3-(p-tolyl)propyl]isoxazole-3-carboxamide CAS Name: N-[3-(4-methylphenyl)propyl]-5-(4-morpholin-4-iumylmethyl)-3-isoxazolecarboxamide IUPAC Name: N-[3-(4-methylphenyl)propyl]-5-(morpholin-4-ium-4-ylmethyl)-1,2-oxazole-3-carboxamide Traditional Name: 5-(morpholin-4-ium-4-ylmethyl)-N-[3-(p-tolyl)propyl]isoxazole-3-carboxamide Formula: C19H26N3O3+ MolecularWeight: 344.42804

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CCCNC(=O)C2=NOC(=C2)C[NH+]3CCOCC3

Isomeric SMILES

CC1=CC=C(C=C1)CCCNC(=O)C2=NOC(=C2)C[NH+]3CCOCC3

InChI

InChI=1S/C19H25N3O3/c1-15-4-6-16(7-5-15)3-2-8-20-19(23)18-13-17(25-21-18)14-22-9-11-24-12-10-22/h4-7,13H,2-3,8-12,14H2,1H3,(H,20,23)/p+1