1-(1-adamantyl)-4-nitro-N-prop-2-enyl-pyrazole-3-carboxamide

Systemtic Name: 1-(1-adamantyl)-4-nitro-N-prop-2-enyl-pyrazole-3-carboxamide Openeye Name: 1-(1-adamantyl)-N-allyl-4-nitro-pyrazole-3-carboxamide CAS Name: 1-(1-adamantyl)-4-nitro-N-prop-2-enyl-3-pyrazolecarboxamide IUPAC Name: 1-(1-adamantyl)-4-nitro-N-prop-2-enylpyrazole-3-carboxamide Traditional Name: 1-(1-adamantyl)-N-allyl-4-nitro-pyrazole-3-carboxamide Formula: C17H22N4O3 MolecularWeight: 330.38158

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=O)C1=NN(C=C1[N+](=O)[O-])C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

C=CCNC(=O)C1=NN(C=C1[N+](=O)[O-])C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C17H22N4O3/c1-2-3-18-16(22)15-14(21(23)24)10-20(19-15)17-7-11-4-12(8-17)6-13(5-11)9-17/h2,10-13H,1,3-9H2,(H,18,22)