(4-nitro-5-propan-2-yl-1,2-oxazol-3-yl)-(4-phenylpiperazin-1-yl)methanone

Systemtic Name: (4-nitro-5-propan-2-yl-1,2-oxazol-3-yl)-(4-phenylpiperazin-1-yl)methanone Openeye Name: (5-isopropyl-4-nitro-isoxazol-3-yl)-(4-phenylpiperazin-1-yl)methanone CAS Name: (4-nitro-5-propan-2-yl-3-isoxazolyl)-(4-phenyl-1-piperazinyl)methanone IUPAC Name: (4-nitro-5-propan-2-yl-1,2-oxazol-3-yl)-(4-phenylpiperazin-1-yl)methanone Traditional Name: (5-isopropyl-4-nitro-isoxazol-3-yl)-(4-phenylpiperazino)methanone Formula: C17H20N4O4 MolecularWeight: 344.3651

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C(=NO1)C(=O)N2CCN(CC2)C3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=C(C(=NO1)C(=O)N2CCN(CC2)C3=CC=CC=C3)[N+](=O)[O-]

InChI

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