4-[(2-methoxy-5-methyl-phenyl)methyl]-N-(5-methyl-1,2-oxazol-3-yl)piperazin-4-ium-1-carboxamide

Systemtic Name: 4-[(2-methoxy-5-methyl-phenyl)methyl]-N-(5-methyl-1,2-oxazol-3-yl)piperazin-4-ium-1-carboxamide Openeye Name: 4-[(2-methoxy-5-methyl-phenyl)methyl]-N-(5-methylisoxazol-3-yl)piperazin-4-ium-1-carboxamide CAS Name: 4-[(2-methoxy-5-methylphenyl)methyl]-N-(5-methyl-3-isoxazolyl)-1-piperazin-4-iumcarboxamide IUPAC Name: 4-[(2-methoxy-5-methylphenyl)methyl]-N-(5-methyl-1,2-oxazol-3-yl)piperazin-4-ium-1-carboxamide Traditional Name: 4-(2-methoxy-5-methyl-benzyl)-N-(5-methylisoxazol-3-yl)piperazin-4-ium-1-carboxamide Formula: C18H25N4O3+ MolecularWeight: 345.4161

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)C[NH+]2CCN(CC2)C(=O)NC3=NOC(=C3)C

Isomeric SMILES

CC1=CC(=C(C=C1)OC)C[NH+]2CCN(CC2)C(=O)NC3=NOC(=C3)C

InChI

InChI=1S/C18H24N4O3/c1-13-4-5-16(24-3)15(10-13)12-21-6-8-22(9-7-21)18(23)19-17-11-14(2)25-20-17/h4-5,10-11H,6-9,12H2,1-3H3,(H,19,20,23)/p+1