(4-cyclopentylpiperazin-4-ium-1-yl)-[2-(3-methoxyphenyl)-1,3-benzoxazol-6-yl]methanone

Systemtic Name: (4-cyclopentylpiperazin-4-ium-1-yl)-[2-(3-methoxyphenyl)-1,3-benzoxazol-6-yl]methanone Openeye Name: (4-cyclopentylpiperazin-4-ium-1-yl)-[2-(3-methoxyphenyl)-1,3-benzoxazol-6-yl]methanone CAS Name: (4-cyclopentyl-1-piperazin-4-iumyl)-[2-(3-methoxyphenyl)-1,3-benzoxazol-6-yl]methanone IUPAC Name: (4-cyclopentylpiperazin-4-ium-1-yl)-[2-(3-methoxyphenyl)-1,3-benzoxazol-6-yl]methanone Traditional Name: (4-cyclopentylpiperazin-4-ium-1-yl)-[2-(3-methoxyphenyl)-1,3-benzoxazol-6-yl]methanone Formula: C24H28N3O3+ MolecularWeight: 406.49742

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=NC3=C(O2)C=C(C=C3)C(=O)N4CC[NH+](CC4)C5CCCC5

Isomeric SMILES

COC1=CC=CC(=C1)C2=NC3=C(O2)C=C(C=C3)C(=O)N4CC[NH+](CC4)C5CCCC5

InChI

InChI=1S/C24H27N3O3/c1-29-20-8-4-5-17(15-20)23-25-21-10-9-18(16-22(21)30-23)24(28)27-13-11-26(12-14-27)19-6-2-3-7-19/h4-5,8-10,15-16,19H,2-3,6-7,11-14H2,1H3/p+1