piperidin-4-ylmethyl 1-[(5-chloranyl-2-propan-2-yl-1-benzofuran-7-yl)methyl]-5-methyl-pyrazole-3-carboxylate

Systemtic Name: piperidin-4-ylmethyl 1-[(5-chloranyl-2-propan-2-yl-1-benzofuran-7-yl)methyl]-5-methyl-pyrazole-3-carboxylate Openeye Name: 4-piperidylmethyl 1-[(5-chloro-2-isopropyl-benzofuran-7-yl)methyl]-5-methyl-pyrazole-3-carboxylate CAS Name: 1-[(5-chloro-2-propan-2-yl-7-benzofuranyl)methyl]-5-methyl-3-pyrazolecarboxylic acid 4-piperidinylmethyl ester IUPAC Name: piperidin-4-ylmethyl 1-[(5-chloro-2-propan-2-yl-1-benzofuran-7-yl)methyl]-5-methylpyrazole-3-carboxylate Traditional Name: 1-[(5-chloro-2-isopropyl-benzofuran-7-yl)methyl]-5-methyl-pyrazole-3-carboxylic acid 4-piperidylmethyl ester Formula: C23H28ClN3O3 MolecularWeight: 429.93972

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CC2=C3C(=CC(=C2)Cl)C=C(O3)C(C)C)C(=O)OCC4CCNCC4

Isomeric SMILES

CC1=CC(=NN1CC2=C3C(=CC(=C2)Cl)C=C(O3)C(C)C)C(=O)OCC4CCNCC4

InChI

InChI=1S/C23H28ClN3O3/c1-14(2)21-11-17-9-19(24)10-18(22(17)30-21)12-27-15(3)8-20(26-27)23(28)29-13-16-4-6-25-7-5-16/h8-11,14,16,25H,4-7,12-13H2,1-3H3