N-(2,3-dimethylphenyl)-2-[4-oxidanylidene-6-[(4-phenylpiperazin-1-yl)methyl]pyran-3-yl]oxy-ethanamide

Systemtic Name: N-(2,3-dimethylphenyl)-2-[4-oxidanylidene-6-[(4-phenylpiperazin-1-yl)methyl]pyran-3-yl]oxy-ethanamide Openeye Name: N-(2,3-dimethylphenyl)-2-[4-oxo-6-[(4-phenylpiperazin-1-yl)methyl]pyran-3-yl]oxy-acetamide CAS Name: N-(2,3-dimethylphenyl)-2-[[4-oxo-6-[(4-phenyl-1-piperazinyl)methyl]-3-pyranyl]oxy]acetamide IUPAC Name: N-(2,3-dimethylphenyl)-2-[4-oxo-6-[(4-phenylpiperazin-1-yl)methyl]pyran-3-yl]oxyacetamide Traditional Name: N-(2,3-dimethylphenyl)-2-[4-keto-6-[(4-phenylpiperazino)methyl]pyran-3-yl]oxy-acetamide Formula: C26H29N3O4 MolecularWeight: 447.52616

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC(=O)COC2=COC(=CC2=O)CN3CCN(CC3)C4=CC=CC=C4)C

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=O)COC2=COC(=CC2=O)CN3CCN(CC3)C4=CC=CC=C4)C

InChI

InChI=1S/C26H29N3O4/c1-19-7-6-10-23(20(19)2)27-26(31)18-33-25-17-32-22(15-24(25)30)16-28-11-13-29(14-12-28)21-8-4-3-5-9-21/h3-10,15,17H,11-14,16,18H2,1-2H3,(H,27,31)