ethyl 5-[(2-acetamidoethylamino)methyl]-1-(2,3-dimethylphenyl)pyrazole-4-carboxylate

Systemtic Name: ethyl 5-[(2-acetamidoethylamino)methyl]-1-(2,3-dimethylphenyl)pyrazole-4-carboxylate Openeye Name: ethyl 5-[(2-acetamidoethylamino)methyl]-1-(2,3-dimethylphenyl)pyrazole-4-carboxylate CAS Name: 5-[(2-acetamidoethylamino)methyl]-1-(2,3-dimethylphenyl)-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[(2-acetamidoethylamino)methyl]-1-(2,3-dimethylphenyl)pyrazole-4-carboxylate Traditional Name: 5-[(2-acetamidoethylamino)methyl]-1-(2,3-dimethylphenyl)pyrazole-4-carboxylic acid ethyl ester Formula: C19H26N4O3 MolecularWeight: 358.43474

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=CC=CC(=C2C)C)CNCCNC(=O)C

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=CC=CC(=C2C)C)CNCCNC(=O)C

InChI

InChI=1S/C19H26N4O3/c1-5-26-19(25)16-11-22-23(17-8-6-7-13(2)14(17)3)18(16)12-20-9-10-21-15(4)24/h6-8,11,20H,5,9-10,12H2,1-4H3,(H,21,24)