ethyl 1-[4-(3-cyclohexyloxypropylcarbamoyl)phenyl]-5-methyl-pyrazole-4-carboxylate

Systemtic Name: ethyl 1-[4-(3-cyclohexyloxypropylcarbamoyl)phenyl]-5-methyl-pyrazole-4-carboxylate Openeye Name: ethyl 1-[4-[3-(cyclohexoxy)propylcarbamoyl]phenyl]-5-methyl-pyrazole-4-carboxylate CAS Name: 1-[4-[(3-cyclohexyloxypropylamino)-oxomethyl]phenyl]-5-methyl-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[4-(3-cyclohexyloxypropylcarbamoyl)phenyl]-5-methylpyrazole-4-carboxylate Traditional Name: 1-[4-[3-(cyclohexoxy)propylcarbamoyl]phenyl]-5-methyl-pyrazole-4-carboxylic acid ethyl ester Formula: C23H31N3O4 MolecularWeight: 413.50994

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)C(=O)NCCCOC3CCCCC3)C

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)C(=O)NCCCOC3CCCCC3)C

InChI

InChI=1S/C23H31N3O4/c1-3-29-23(28)21-16-25-26(17(21)2)19-12-10-18(11-13-19)22(27)24-14-7-15-30-20-8-5-4-6-9-20/h10-13,16,20H,3-9,14-15H2,1-2H3,(H,24,27)