6-(3-chlorophenyl)carbonyl-5-methyl-3-[(4-pyridin-2-ylpiperazin-1-yl)methyl]-1,3-benzoxazol-2-one

Systemtic Name: 6-(3-chlorophenyl)carbonyl-5-methyl-3-[(4-pyridin-2-ylpiperazin-1-yl)methyl]-1,3-benzoxazol-2-one Openeye Name: 6-(3-chlorobenzoyl)-5-methyl-3-[[4-(2-pyridyl)piperazin-1-yl]methyl]-1,3-benzoxazol-2-one CAS Name: 6-[(3-chlorophenyl)-oxomethyl]-5-methyl-3-[[4-(2-pyridinyl)-1-piperazinyl]methyl]-1,3-benzoxazol-2-one IUPAC Name: 6-(3-chlorobenzoyl)-5-methyl-3-[(4-pyridin-2-ylpiperazin-1-yl)methyl]-1,3-benzoxazol-2-one Traditional Name: 6-(3-chlorobenzoyl)-5-methyl-3-[[4-(2-pyridyl)piperazino]methyl]-1,3-benzoxazol-2-one Formula: C25H23ClN4O3 MolecularWeight: 462.92812

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C(=O)C3=CC(=CC=C3)Cl)OC(=O)N2CN4CCN(CC4)C5=CC=CC=N5

Isomeric SMILES

CC1=CC2=C(C=C1C(=O)C3=CC(=CC=C3)Cl)OC(=O)N2CN4CCN(CC4)C5=CC=CC=N5

InChI

InChI=1S/C25H23ClN4O3/c1-17-13-21-22(15-20(17)24(31)18-5-4-6-19(26)14-18)33-25(32)30(21)16-28-9-11-29(12-10-28)23-7-2-3-8-27-23/h2-8,13-15H,9-12,16H2,1H3