7-[4-oxidanyl-4-[(3-phenylphenyl)methyl]piperazin-4-ium-1-yl]-3H-1,3-benzoxazol-2-one

Systemtic Name: 7-[4-oxidanyl-4-[(3-phenylphenyl)methyl]piperazin-4-ium-1-yl]-3H-1,3-benzoxazol-2-one Openeye Name: 7-[4-hydroxy-4-[(3-phenylphenyl)methyl]piperazin-4-ium-1-yl]-3H-1,3-benzoxazol-2-one CAS Name: 7-[4-hydroxy-4-[(3-phenylphenyl)methyl]-1-piperazin-4-iumyl]-3H-1,3-benzoxazol-2-one IUPAC Name: 7-[4-hydroxy-4-[(3-phenylphenyl)methyl]piperazin-4-ium-1-yl]-3H-1,3-benzoxazol-2-one Traditional Name: 7-[4-hydroxy-4-(3-phenylbenzyl)piperazin-4-ium-1-yl]-3H-1,3-benzoxazol-2-one Formula: C24H24N3O3+ MolecularWeight: 402.46566

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Descriptors Computed from Structure

Canonical SMILES:

C1C[N+](CCN1C2=CC=CC3=C2OC(=O)N3)(CC4=CC=CC(=C4)C5=CC=CC=C5)O

Isomeric SMILES

C1C[N+](CCN1C2=CC=CC3=C2OC(=O)N3)(CC4=CC=CC(=C4)C5=CC=CC=C5)O

InChI

InChI=1S/C24H23N3O3/c28-24-25-21-10-5-11-22(23(21)30-24)26-12-14-27(29,15-13-26)17-18-6-4-9-20(16-18)19-7-2-1-3-8-19/h1-11,16,29H,12-15,17H2/p+1