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

Systemtic Name: 5-(2-chlorophenyl)carbonyl-3-[(4-phenylpiperazin-1-yl)methyl]-1,3-benzoxazol-2-one Openeye Name: 5-(2-chlorobenzoyl)-3-[(4-phenylpiperazin-1-yl)methyl]-1,3-benzoxazol-2-one CAS Name: 5-[(2-chlorophenyl)-oxomethyl]-3-[(4-phenyl-1-piperazinyl)methyl]-1,3-benzoxazol-2-one IUPAC Name: 5-(2-chlorobenzoyl)-3-[(4-phenylpiperazin-1-yl)methyl]-1,3-benzoxazol-2-one Traditional Name: 5-(2-chlorobenzoyl)-3-[(4-phenylpiperazino)methyl]-1,3-benzoxazol-2-one Formula: C25H22ClN3O3 MolecularWeight: 447.91348

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CN2C3=C(C=CC(=C3)C(=O)C4=CC=CC=C4Cl)OC2=O)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1CN2C3=C(C=CC(=C3)C(=O)C4=CC=CC=C4Cl)OC2=O)C5=CC=CC=C5

InChI

InChI=1S/C25H22ClN3O3/c26-21-9-5-4-8-20(21)24(30)18-10-11-23-22(16-18)29(25(31)32-23)17-27-12-14-28(15-13-27)19-6-2-1-3-7-19/h1-11,16H,12-15,17H2