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

Systemtic Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]-3-methyl-1,2-oxazole-5-carboxamide Openeye Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]-3-methyl-isoxazole-5-carboxamide CAS Name: N-[4-(4-ethyl-1-piperazin-4-iumyl)phenyl]-3-methyl-5-isoxazolecarboxamide IUPAC Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]-3-methyl-1,2-oxazole-5-carboxamide Traditional Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]-3-methyl-isoxazole-5-carboxamide Formula: C17H23N4O2+ MolecularWeight: 315.39012

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=CC=C(C=C2)NC(=O)C3=CC(=NO3)C

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=CC=C(C=C2)NC(=O)C3=CC(=NO3)C

InChI

InChI=1S/C17H22N4O2/c1-3-20-8-10-21(11-9-20)15-6-4-14(5-7-15)18-17(22)16-12-13(2)19-23-16/h4-7,12H,3,8-11H2,1-2H3,(H,18,22)/p+1