N-(5-methyl-1,2-oxazol-3-yl)-2-[4-[(4-nitrophenyl)methyl]piperazin-1-yl]ethanamide

Systemtic Name: N-(5-methyl-1,2-oxazol-3-yl)-2-[4-[(4-nitrophenyl)methyl]piperazin-1-yl]ethanamide Openeye Name: N-(5-methylisoxazol-3-yl)-2-[4-[(4-nitrophenyl)methyl]piperazin-1-yl]acetamide CAS Name: N-(5-methyl-3-isoxazolyl)-2-[4-[(4-nitrophenyl)methyl]-1-piperazinyl]acetamide IUPAC Name: N-(5-methyl-1,2-oxazol-3-yl)-2-[4-[(4-nitrophenyl)methyl]piperazin-1-yl]acetamide Traditional Name: N-(5-methylisoxazol-3-yl)-2-[4-(4-nitrobenzyl)piperazino]acetamide Formula: C17H21N5O4 MolecularWeight: 359.37974

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC(=O)CN2CCN(CC2)CC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=NO1)NC(=O)CN2CCN(CC2)CC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H21N5O4/c1-13-10-16(19-26-13)18-17(23)12-21-8-6-20(7-9-21)11-14-2-4-15(5-3-14)22(24)25/h2-5,10H,6-9,11-12H2,1H3,(H,18,19,23)