N-[1-(1-adamantyl)pyrazol-3-yl]-3-(5-methyl-4-nitro-pyrazol-1-yl)propanamide

Systemtic Name: N-[1-(1-adamantyl)pyrazol-3-yl]-3-(5-methyl-4-nitro-pyrazol-1-yl)propanamide Openeye Name: N-[1-(1-adamantyl)pyrazol-3-yl]-3-(5-methyl-4-nitro-pyrazol-1-yl)propanamide CAS Name: N-[1-(1-adamantyl)-3-pyrazolyl]-3-(5-methyl-4-nitro-1-pyrazolyl)propanamide IUPAC Name: N-[1-(1-adamantyl)pyrazol-3-yl]-3-(5-methyl-4-nitropyrazol-1-yl)propanamide Traditional Name: N-[1-(1-adamantyl)pyrazol-3-yl]-3-(5-methyl-4-nitro-pyrazol-1-yl)propionamide Formula: C20H26N6O3 MolecularWeight: 398.45884

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1CCC(=O)NC2=NN(C=C2)C34CC5CC(C3)CC(C5)C4)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=NN1CCC(=O)NC2=NN(C=C2)C34CC5CC(C3)CC(C5)C4)[N+](=O)[O-]

InChI

InChI=1S/C20H26N6O3/c1-13-17(26(28)29)12-21-24(13)4-3-19(27)22-18-2-5-25(23-18)20-9-14-6-15(10-20)8-16(7-14)11-20/h2,5,12,14-16H,3-4,6-11H2,1H3,(H,22,23,27)