N-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(phenylmethyl)piperazin-4-ium-1-carboxamide

Systemtic Name: N-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(phenylmethyl)piperazin-4-ium-1-carboxamide Openeye Name: 4-benzyl-N-(3,5-dimethylisoxazol-4-yl)piperazin-4-ium-1-carboxamide CAS Name: N-(3,5-dimethyl-4-isoxazolyl)-4-(phenylmethyl)-1-piperazin-4-iumcarboxamide IUPAC Name: 4-benzyl-N-(3,5-dimethyl-1,2-oxazol-4-yl)piperazin-4-ium-1-carboxamide Traditional Name: 4-benzyl-N-(3,5-dimethylisoxazol-4-yl)piperazin-4-ium-1-carboxamide Formula: C17H23N4O2+ MolecularWeight: 315.39012

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)NC(=O)N2CC[NH+](CC2)CC3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=NO1)C)NC(=O)N2CC[NH+](CC2)CC3=CC=CC=C3

InChI

InChI=1S/C17H22N4O2/c1-13-16(14(2)23-19-13)18-17(22)21-10-8-20(9-11-21)12-15-6-4-3-5-7-15/h3-7H,8-12H2,1-2H3,(H,18,22)/p+1