propan-2-yl 1-ethyl-4-[2-[3-(4-nitropyrazol-1-yl)-1-adamantyl]ethanoylamino]pyrazole-3-carboxylate

Systemtic Name: propan-2-yl 1-ethyl-4-[2-[3-(4-nitropyrazol-1-yl)-1-adamantyl]ethanoylamino]pyrazole-3-carboxylate Openeye Name: isopropyl 1-ethyl-4-[[2-[3-(4-nitropyrazol-1-yl)-1-adamantyl]acetyl]amino]pyrazole-3-carboxylate CAS Name: 1-ethyl-4-[[2-[3-(4-nitro-1-pyrazolyl)-1-adamantyl]-1-oxoethyl]amino]-3-pyrazolecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 1-ethyl-4-[[2-[3-(4-nitropyrazol-1-yl)-1-adamantyl]acetyl]amino]pyrazole-3-carboxylate Traditional Name: 1-ethyl-4-[[2-[3-(4-nitropyrazol-1-yl)-1-adamantyl]acetyl]amino]pyrazole-3-carboxylic acid isopropyl ester Formula: C24H32N6O5 MolecularWeight: 484.54808

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C(=O)OC(C)C)NC(=O)CC23CC4CC(C2)CC(C4)(C3)N5C=C(C=N5)[N+](=O)[O-]

Isomeric SMILES

CCN1C=C(C(=N1)C(=O)OC(C)C)NC(=O)CC23CC4CC(C2)CC(C4)(C3)N5C=C(C=N5)[N+](=O)[O-]

InChI

InChI=1S/C24H32N6O5/c1-4-28-13-19(21(27-28)22(32)35-15(2)3)26-20(31)10-23-6-16-5-17(7-23)9-24(8-16,14-23)29-12-18(11-25-29)30(33)34/h11-13,15-17H,4-10,14H2,1-3H3,(H,26,31)