N-[4-chloranyl-1-(phenylmethyl)pyrazol-3-yl]-3-(3-methoxy-4-nitro-pyrazol-1-yl)propanamide

Systemtic Name: N-[4-chloranyl-1-(phenylmethyl)pyrazol-3-yl]-3-(3-methoxy-4-nitro-pyrazol-1-yl)propanamide Openeye Name: N-(1-benzyl-4-chloro-pyrazol-3-yl)-3-(3-methoxy-4-nitro-pyrazol-1-yl)propanamide CAS Name: N-[4-chloro-1-(phenylmethyl)-3-pyrazolyl]-3-(3-methoxy-4-nitro-1-pyrazolyl)propanamide IUPAC Name: N-(1-benzyl-4-chloropyrazol-3-yl)-3-(3-methoxy-4-nitropyrazol-1-yl)propanamide Traditional Name: N-(1-benzyl-4-chloro-pyrazol-3-yl)-3-(3-methoxy-4-nitro-pyrazol-1-yl)propionamide Formula: C17H17ClN6O4 MolecularWeight: 404.80768

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NN(C=C1[N+](=O)[O-])CCC(=O)NC2=NN(C=C2Cl)CC3=CC=CC=C3

Isomeric SMILES

COC1=NN(C=C1[N+](=O)[O-])CCC(=O)NC2=NN(C=C2Cl)CC3=CC=CC=C3

InChI

InChI=1S/C17H17ClN6O4/c1-28-17-14(24(26)27)11-22(21-17)8-7-15(25)19-16-13(18)10-23(20-16)9-12-5-3-2-4-6-12/h2-6,10-11H,7-9H2,1H3,(H,19,20,25)