3-[(4-phenylpiperazin-1-ium-1-yl)methyl]-1,3-benzoxazol-2-one

Systemtic Name: 3-[(4-phenylpiperazin-1-ium-1-yl)methyl]-1,3-benzoxazol-2-one Openeye Name: 3-[(4-phenylpiperazin-1-ium-1-yl)methyl]-1,3-benzoxazol-2-one CAS Name: 3-[(4-phenyl-1-piperazin-1-iumyl)methyl]-1,3-benzoxazol-2-one IUPAC Name: 3-[(4-phenylpiperazin-1-ium-1-yl)methyl]-1,3-benzoxazol-2-one Traditional Name: 3-[(4-phenylpiperazin-1-ium-1-yl)methyl]-1,3-benzoxazol-2-one Formula: C18H20N3O2+ MolecularWeight: 310.3703

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CN2C3=CC=CC=C3OC2=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CC[NH+]1CN2C3=CC=CC=C3OC2=O)C4=CC=CC=C4

InChI

InChI=1S/C18H19N3O2/c22-18-21(16-8-4-5-9-17(16)23-18)14-19-10-12-20(13-11-19)15-6-2-1-3-7-15/h1-9H,10-14H2/p+1