N-[3-(4-bromanyl-3-methyl-pyrazol-1-yl)propyl]-3-(4-nitropyrazol-1-yl)propanamide

Systemtic Name: N-[3-(4-bromanyl-3-methyl-pyrazol-1-yl)propyl]-3-(4-nitropyrazol-1-yl)propanamide Openeye Name: N-[3-(4-bromo-3-methyl-pyrazol-1-yl)propyl]-3-(4-nitropyrazol-1-yl)propanamide CAS Name: N-[3-(4-bromo-3-methyl-1-pyrazolyl)propyl]-3-(4-nitro-1-pyrazolyl)propanamide IUPAC Name: N-[3-(4-bromo-3-methylpyrazol-1-yl)propyl]-3-(4-nitropyrazol-1-yl)propanamide Traditional Name: N-[3-(4-bromo-3-methyl-pyrazol-1-yl)propyl]-3-(4-nitropyrazol-1-yl)propionamide Formula: C13H17BrN6O3 MolecularWeight: 385.21648

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1Br)CCCNC(=O)CCN2C=C(C=N2)[N+](=O)[O-]

Isomeric SMILES

CC1=NN(C=C1Br)CCCNC(=O)CCN2C=C(C=N2)[N+](=O)[O-]

InChI

InChI=1S/C13H17BrN6O3/c1-10-12(14)9-19(17-10)5-2-4-15-13(21)3-6-18-8-11(7-16-18)20(22)23/h7-9H,2-6H2,1H3,(H,15,21)