methyl 6-(cyclooctylcarbamoyl)-5-(3-ethylphenyl)-6-methyl-4-oxidanylidene-7H-pyrazolo[1,5-a]pyrazine-2-carboxylate

Systemtic Name: methyl 6-(cyclooctylcarbamoyl)-5-(3-ethylphenyl)-6-methyl-4-oxidanylidene-7H-pyrazolo[1,5-a]pyrazine-2-carboxylate Openeye Name: methyl 6-(cyclooctylcarbamoyl)-5-(3-ethylphenyl)-6-methyl-4-oxo-7H-pyrazolo[1,5-a]pyrazine-2-carboxylate CAS Name: 6-[(cyclooctylamino)-oxomethyl]-5-(3-ethylphenyl)-6-methyl-4-oxo-7H-pyrazolo[1,5-a]pyrazine-2-carboxylic acid methyl ester IUPAC Name: methyl 6-(cyclooctylcarbamoyl)-5-(3-ethylphenyl)-6-methyl-4-oxo-7H-pyrazolo[1,5-a]pyrazine-2-carboxylate Traditional Name: 6-(cyclooctylcarbamoyl)-5-(3-ethylphenyl)-4-keto-6-methyl-7H-pyrazolo[1,5-a]pyrazine-2-carboxylic acid methyl ester Formula: C26H34N4O4 MolecularWeight: 466.57256

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)N2C(=O)C3=CC(=NN3CC2(C)C(=O)NC4CCCCCCC4)C(=O)OC

Isomeric SMILES

CCC1=CC(=CC=C1)N2C(=O)C3=CC(=NN3CC2(C)C(=O)NC4CCCCCCC4)C(=O)OC

InChI

InChI=1S/C26H34N4O4/c1-4-18-11-10-14-20(15-18)30-23(31)22-16-21(24(32)34-3)28-29(22)17-26(30,2)25(33)27-19-12-8-6-5-7-9-13-19/h10-11,14-16,19H,4-9,12-13,17H2,1-3H3,(H,27,33)