ethyl 6-(cyclooctylcarbamoyl)-5-[(4-methoxyphenyl)methyl]-6-methyl-4-oxidanylidene-7H-pyrazolo[1,5-a]pyrazine-2-carboxylate

Systemtic Name: ethyl 6-(cyclooctylcarbamoyl)-5-[(4-methoxyphenyl)methyl]-6-methyl-4-oxidanylidene-7H-pyrazolo[1,5-a]pyrazine-2-carboxylate Openeye Name: ethyl 6-(cyclooctylcarbamoyl)-5-[(4-methoxyphenyl)methyl]-6-methyl-4-oxo-7H-pyrazolo[1,5-a]pyrazine-2-carboxylate CAS Name: 6-[(cyclooctylamino)-oxomethyl]-5-[(4-methoxyphenyl)methyl]-6-methyl-4-oxo-7H-pyrazolo[1,5-a]pyrazine-2-carboxylic acid ethyl ester IUPAC Name: ethyl 6-(cyclooctylcarbamoyl)-5-[(4-methoxyphenyl)methyl]-6-methyl-4-oxo-7H-pyrazolo[1,5-a]pyrazine-2-carboxylate Traditional Name: 6-(cyclooctylcarbamoyl)-4-keto-6-methyl-5-p-anisyl-7H-pyrazolo[1,5-a]pyrazine-2-carboxylic acid ethyl ester Formula: C27H36N4O5 MolecularWeight: 496.59854

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN2CC(N(C(=O)C2=C1)CC3=CC=C(C=C3)OC)(C)C(=O)NC4CCCCCCC4

Isomeric SMILES

CCOC(=O)C1=NN2CC(N(C(=O)C2=C1)CC3=CC=C(C=C3)OC)(C)C(=O)NC4CCCCCCC4

InChI

InChI=1S/C27H36N4O5/c1-4-36-25(33)22-16-23-24(32)30(17-19-12-14-21(35-3)15-13-19)27(2,18-31(23)29-22)26(34)28-20-10-8-6-5-7-9-11-20/h12-16,20H,4-11,17-18H2,1-3H3,(H,28,34)