1-[4-(1,3-benzoxazol-2-yl)piperidin-1-yl]-2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)ethanone

Systemtic Name: 1-[4-(1,3-benzoxazol-2-yl)piperidin-1-yl]-2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)ethanone Openeye Name: 1-[4-(1,3-benzoxazol-2-yl)-1-piperidyl]-2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)ethanone CAS Name: 1-[4-(1,3-benzoxazol-2-yl)-1-piperidinyl]-2-(3,5-dimethyl-4-nitro-1-pyrazolyl)ethanone IUPAC Name: 1-[4-(1,3-benzoxazol-2-yl)piperidin-1-yl]-2-(3,5-dimethyl-4-nitropyrazol-1-yl)ethanone Traditional Name: 1-[4-(1,3-benzoxazol-2-yl)piperidino]-2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)ethanone Formula: C19H21N5O4 MolecularWeight: 383.40114

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(=O)N2CCC(CC2)C3=NC4=CC=CC=C4O3)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC(=O)N2CCC(CC2)C3=NC4=CC=CC=C4O3)C)[N+](=O)[O-]

InChI

InChI=1S/C19H21N5O4/c1-12-18(24(26)27)13(2)23(21-12)11-17(25)22-9-7-14(8-10-22)19-20-15-5-3-4-6-16(15)28-19/h3-6,14H,7-11H2,1-2H3