1-[4-[(3-methyl-1,2-oxazol-5-yl)methyl]piperazin-1-yl]-2-(3-nitrophenoxy)ethanone

Systemtic Name: 1-[4-[(3-methyl-1,2-oxazol-5-yl)methyl]piperazin-1-yl]-2-(3-nitrophenoxy)ethanone Openeye Name: 1-[4-[(3-methylisoxazol-5-yl)methyl]piperazin-1-yl]-2-(3-nitrophenoxy)ethanone CAS Name: 1-[4-[(3-methyl-5-isoxazolyl)methyl]-1-piperazinyl]-2-(3-nitrophenoxy)ethanone IUPAC Name: 1-[4-[(3-methyl-1,2-oxazol-5-yl)methyl]piperazin-1-yl]-2-(3-nitrophenoxy)ethanone Traditional Name: 1-[4-[(3-methylisoxazol-5-yl)methyl]piperazino]-2-(3-nitrophenoxy)ethanone Formula: C17H20N4O5 MolecularWeight: 360.3645

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1)CN2CCN(CC2)C(=O)COC3=CC=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=NOC(=C1)CN2CCN(CC2)C(=O)COC3=CC=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H20N4O5/c1-13-9-16(26-18-13)11-19-5-7-20(8-6-19)17(22)12-25-15-4-2-3-14(10-15)21(23)24/h2-4,9-10H,5-8,11-12H2,1H3