1-(1-adamantyl)-N-[1-[(3-chlorophenyl)methyl]pyrazol-4-yl]-4-nitro-pyrazole-3-carboxamide

Systemtic Name: 1-(1-adamantyl)-N-[1-[(3-chlorophenyl)methyl]pyrazol-4-yl]-4-nitro-pyrazole-3-carboxamide Openeye Name: 1-(1-adamantyl)-N-[1-[(3-chlorophenyl)methyl]pyrazol-4-yl]-4-nitro-pyrazole-3-carboxamide CAS Name: 1-(1-adamantyl)-N-[1-[(3-chlorophenyl)methyl]-4-pyrazolyl]-4-nitro-3-pyrazolecarboxamide IUPAC Name: 1-(1-adamantyl)-N-[1-[(3-chlorophenyl)methyl]pyrazol-4-yl]-4-nitropyrazole-3-carboxamide Traditional Name: 1-(1-adamantyl)-N-[1-(3-chlorobenzyl)pyrazol-4-yl]-4-nitro-pyrazole-3-carboxamide Formula: C24H25ClN6O3 MolecularWeight: 480.9467

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)N4C=C(C(=N4)C(=O)NC5=CN(N=C5)CC6=CC(=CC=C6)Cl)[N+](=O)[O-]

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)N4C=C(C(=N4)C(=O)NC5=CN(N=C5)CC6=CC(=CC=C6)Cl)[N+](=O)[O-]

InChI

InChI=1S/C24H25ClN6O3/c25-19-3-1-2-15(7-19)12-29-13-20(11-26-29)27-23(32)22-21(31(33)34)14-30(28-22)24-8-16-4-17(9-24)6-18(5-16)10-24/h1-3,7,11,13-14,16-18H,4-6,8-10,12H2,(H,27,32)