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

Systemtic Name: 6-(2-chlorophenyl)carbonyl-5-methyl-3-[(4-phenylpiperazin-1-yl)methyl]-1,3-benzoxazol-2-one Openeye Name: 6-(2-chlorobenzoyl)-5-methyl-3-[(4-phenylpiperazin-1-yl)methyl]-1,3-benzoxazol-2-one CAS Name: 6-[(2-chlorophenyl)-oxomethyl]-5-methyl-3-[(4-phenyl-1-piperazinyl)methyl]-1,3-benzoxazol-2-one IUPAC Name: 6-(2-chlorobenzoyl)-5-methyl-3-[(4-phenylpiperazin-1-yl)methyl]-1,3-benzoxazol-2-one Traditional Name: 6-(2-chlorobenzoyl)-5-methyl-3-[(4-phenylpiperazino)methyl]-1,3-benzoxazol-2-one Formula: C26H24ClN3O3 MolecularWeight: 461.94006

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C(=O)C3=CC=CC=C3Cl)OC(=O)N2CN4CCN(CC4)C5=CC=CC=C5

Isomeric SMILES

CC1=CC2=C(C=C1C(=O)C3=CC=CC=C3Cl)OC(=O)N2CN4CCN(CC4)C5=CC=CC=C5

InChI

InChI=1S/C26H24ClN3O3/c1-18-15-23-24(16-21(18)25(31)20-9-5-6-10-22(20)27)33-26(32)30(23)17-28-11-13-29(14-12-28)19-7-3-2-4-8-19/h2-10,15-16H,11-14,17H2,1H3