2-benzo[e][1]benzofuran-1-yl-1-[4-[(5-methyl-1,2-oxazol-3-yl)methyl]piperazin-4-ium-1-yl]ethanone

Systemtic Name: 2-benzo[e][1]benzofuran-1-yl-1-[4-[(5-methyl-1,2-oxazol-3-yl)methyl]piperazin-4-ium-1-yl]ethanone Openeye Name: 2-benzo[e]benzofuran-1-yl-1-[4-[(5-methylisoxazol-3-yl)methyl]piperazin-4-ium-1-yl]ethanone CAS Name: 2-(1-benzo[e]benzofuranyl)-1-[4-[(5-methyl-3-isoxazolyl)methyl]-1-piperazin-4-iumyl]ethanone IUPAC Name: 2-benzo[e][1]benzofuran-1-yl-1-[4-[(5-methyl-1,2-oxazol-3-yl)methyl]piperazin-4-ium-1-yl]ethanone Traditional Name: 2-benzo[e]benzofuran-1-yl-1-[4-[(5-methylisoxazol-3-yl)methyl]piperazin-4-ium-1-yl]ethanone Formula: C23H24N3O3+ MolecularWeight: 390.45496

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)C[NH+]2CCN(CC2)C(=O)CC3=COC4=C3C5=CC=CC=C5C=C4

Isomeric SMILES

CC1=CC(=NO1)C[NH+]2CCN(CC2)C(=O)CC3=COC4=C3C5=CC=CC=C5C=C4

InChI

InChI=1S/C23H23N3O3/c1-16-12-19(24-29-16)14-25-8-10-26(11-9-25)22(27)13-18-15-28-21-7-6-17-4-2-3-5-20(17)23(18)21/h2-7,12,15H,8-11,13-14H2,1H3/p+1