methyl 2-[[3-(1-benzofuran-2-yl)-1-(phenylmethyl)pyrazol-4-yl]methyl-methyl-amino]ethanoate

Systemtic Name: methyl 2-[[3-(1-benzofuran-2-yl)-1-(phenylmethyl)pyrazol-4-yl]methyl-methyl-amino]ethanoate Openeye Name: methyl 2-[[3-(benzofuran-2-yl)-1-benzyl-pyrazol-4-yl]methyl-methyl-amino]acetate CAS Name: 2-[[3-(2-benzofuranyl)-1-(phenylmethyl)-4-pyrazolyl]methyl-methylamino]acetic acid methyl ester IUPAC Name: methyl 2-[[3-(1-benzofuran-2-yl)-1-benzylpyrazol-4-yl]methyl-methylamino]acetate Traditional Name: 2-[[3-(benzofuran-2-yl)-1-benzyl-pyrazol-4-yl]methyl-methyl-amino]acetic acid methyl ester Formula: C23H23N3O3 MolecularWeight: 389.44702

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CN(N=C1C2=CC3=CC=CC=C3O2)CC4=CC=CC=C4)CC(=O)OC

Isomeric SMILES

CN(CC1=CN(N=C1C2=CC3=CC=CC=C3O2)CC4=CC=CC=C4)CC(=O)OC

InChI

InChI=1S/C23H23N3O3/c1-25(16-22(27)28-2)14-19-15-26(13-17-8-4-3-5-9-17)24-23(19)21-12-18-10-6-7-11-20(18)29-21/h3-12,15H,13-14,16H2,1-2H3