N-[5-tert-butyl-2-(4-nitrophenyl)pyrazol-3-yl]-3-chloranyl-propanamide

Systemtic Name: N-[5-tert-butyl-2-(4-nitrophenyl)pyrazol-3-yl]-3-chloranyl-propanamide Openeye Name: N-[5-tert-butyl-2-(4-nitrophenyl)pyrazol-3-yl]-3-chloro-propanamide CAS Name: N-[5-tert-butyl-2-(4-nitrophenyl)-3-pyrazolyl]-3-chloropropanamide IUPAC Name: N-[5-tert-butyl-2-(4-nitrophenyl)pyrazol-3-yl]-3-chloropropanamide Traditional Name: N-[5-tert-butyl-2-(4-nitrophenyl)pyrazol-3-yl]-3-chloro-propionamide Formula: C16H19ClN4O3 MolecularWeight: 350.80006

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C(=C1)NC(=O)CCCl)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C1=NN(C(=C1)NC(=O)CCCl)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H19ClN4O3/c1-16(2,3)13-10-14(18-15(22)8-9-17)20(19-13)11-4-6-12(7-5-11)21(23)24/h4-7,10H,8-9H2,1-3H3,(H,18,22)