N-[4-chloranyl-2-(phenylcarbonyl)phenyl]-3-(3-methoxy-4-nitro-pyrazol-1-yl)propanamide

Systemtic Name: N-[4-chloranyl-2-(phenylcarbonyl)phenyl]-3-(3-methoxy-4-nitro-pyrazol-1-yl)propanamide Openeye Name: N-(2-benzoyl-4-chloro-phenyl)-3-(3-methoxy-4-nitro-pyrazol-1-yl)propanamide CAS Name: N-(2-benzoyl-4-chlorophenyl)-3-(3-methoxy-4-nitro-1-pyrazolyl)propanamide IUPAC Name: N-(2-benzoyl-4-chlorophenyl)-3-(3-methoxy-4-nitropyrazol-1-yl)propanamide Traditional Name: N-(2-benzoyl-4-chloro-phenyl)-3-(3-methoxy-4-nitro-pyrazol-1-yl)propionamide Formula: C20H17ClN4O5 MolecularWeight: 428.82578

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NN(C=C1[N+](=O)[O-])CCC(=O)NC2=C(C=C(C=C2)Cl)C(=O)C3=CC=CC=C3

Isomeric SMILES

COC1=NN(C=C1[N+](=O)[O-])CCC(=O)NC2=C(C=C(C=C2)Cl)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H17ClN4O5/c1-30-20-17(25(28)29)12-24(23-20)10-9-18(26)22-16-8-7-14(21)11-15(16)19(27)13-5-3-2-4-6-13/h2-8,11-12H,9-10H2,1H3,(H,22,26)