1-(1-adamantyl)-4-nitro-N-(quinolin-6-ylmethyl)pyrazole-3-carboxamide

Systemtic Name: 1-(1-adamantyl)-4-nitro-N-(quinolin-6-ylmethyl)pyrazole-3-carboxamide Openeye Name: 1-(1-adamantyl)-4-nitro-N-(6-quinolylmethyl)pyrazole-3-carboxamide CAS Name: 1-(1-adamantyl)-4-nitro-N-(6-quinolinylmethyl)-3-pyrazolecarboxamide IUPAC Name: 1-(1-adamantyl)-4-nitro-N-(quinolin-6-ylmethyl)pyrazole-3-carboxamide Traditional Name: 1-(1-adamantyl)-4-nitro-N-(6-quinolylmethyl)pyrazole-3-carboxamide Formula: C24H25N5O3 MolecularWeight: 431.487

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)N4C=C(C(=N4)C(=O)NCC5=CC6=C(C=C5)N=CC=C6)[N+](=O)[O-]

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)N4C=C(C(=N4)C(=O)NCC5=CC6=C(C=C5)N=CC=C6)[N+](=O)[O-]

InChI

InChI=1S/C24H25N5O3/c30-23(26-13-15-3-4-20-19(9-15)2-1-5-25-20)22-21(29(31)32)14-28(27-22)24-10-16-6-17(11-24)8-18(7-16)12-24/h1-5,9,14,16-18H,6-8,10-13H2,(H,26,30)