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

Systemtic Name: (2-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]-(2-methyl-3-nitro-phenyl)methanone CAS Name: [4-[(3-methyl-5-isoxazolyl)methyl]-1-piperazinyl]-(2-methyl-3-nitrophenyl)methanone IUPAC Name: (2-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]-(2-methyl-3-nitro-phenyl)methanone Formula: C17H20N4O4 MolecularWeight: 344.3651

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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