[2,5-dimethyl-4-[(2-nitrophenyl)amino]pyrazol-3-yl]-piperidin-1-yl-methanone

Systemtic Name: [2,5-dimethyl-4-[(2-nitrophenyl)amino]pyrazol-3-yl]-piperidin-1-yl-methanone Openeye Name: [2,5-dimethyl-4-(2-nitroanilino)pyrazol-3-yl]-(1-piperidyl)methanone CAS Name: [2,5-dimethyl-4-(2-nitroanilino)-3-pyrazolyl]-(1-piperidinyl)methanone IUPAC Name: [2,5-dimethyl-4-(2-nitroanilino)pyrazol-3-yl]-piperidin-1-ylmethanone Traditional Name: [2,5-dimethyl-4-(2-nitroanilino)pyrazol-3-yl]-piperidino-methanone Formula: C17H21N5O3 MolecularWeight: 343.38034

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1NC2=CC=CC=C2[N+](=O)[O-])C(=O)N3CCCCC3)C

Isomeric SMILES

CC1=NN(C(=C1NC2=CC=CC=C2[N+](=O)[O-])C(=O)N3CCCCC3)C

InChI

InChI=1S/C17H21N5O3/c1-12-15(18-13-8-4-5-9-14(13)22(24)25)16(20(2)19-12)17(23)21-10-6-3-7-11-21/h4-5,8-9,18H,3,6-7,10-11H2,1-2H3