(4-methyl-3-nitro-phenyl)-[4-[(3-methyl-1,2-oxazol-5-yl)methyl]piperazin-1-yl]methanone

Systemtic Name: (4-methyl-3-nitro-phenyl)-[4-[(3-methyl-1,2-oxazol-5-yl)methyl]piperazin-1-yl]methanone Openeye Name: [4-[(3-methylisoxazol-5-yl)methyl]piperazin-1-yl]-(4-methyl-3-nitro-phenyl)methanone CAS Name: [4-[(3-methyl-5-isoxazolyl)methyl]-1-piperazinyl]-(4-methyl-3-nitrophenyl)methanone IUPAC Name: (4-methyl-3-nitrophenyl)-[4-[(3-methyl-1,2-oxazol-5-yl)methyl]piperazin-1-yl]methanone Traditional Name: [4-[(3-methylisoxazol-5-yl)methyl]piperazino]-(4-methyl-3-nitro-phenyl)methanone Formula: C17H20N4O4 MolecularWeight: 344.3651

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)N2CCN(CC2)CC3=CC(=NO3)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N2CCN(CC2)CC3=CC(=NO3)C)[N+](=O)[O-]

InChI

InChI=1S/C17H20N4O4/c1-12-3-4-14(10-16(12)21(23)24)17(22)20-7-5-19(6-8-20)11-15-9-13(2)18-25-15/h3-4,9-10H,5-8,11H2,1-2H3