4-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N-(3-nitrophenyl)piperazine-1-carboxamide

Systemtic Name: 4-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N-(3-nitrophenyl)piperazine-1-carboxamide Openeye Name: 4-[(3,5-dimethylisoxazol-4-yl)methyl]-N-(3-nitrophenyl)piperazine-1-carboxamide CAS Name: 4-[(3,5-dimethyl-4-isoxazolyl)methyl]-N-(3-nitrophenyl)-1-piperazinecarboxamide IUPAC Name: 4-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N-(3-nitrophenyl)piperazine-1-carboxamide Traditional Name: 4-[(3,5-dimethylisoxazol-4-yl)methyl]-N-(3-nitrophenyl)piperazine-1-carboxamide Formula: C17H21N5O4 MolecularWeight: 359.37974

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)CN2CCN(CC2)C(=O)NC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NO1)C)CN2CCN(CC2)C(=O)NC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H21N5O4/c1-12-16(13(2)26-19-12)11-20-6-8-21(9-7-20)17(23)18-14-4-3-5-15(10-14)22(24)25/h3-5,10H,6-9,11H2,1-2H3,(H,18,23)