(4-cyclopentylpiperazin-4-ium-1-yl)-[5-(isoquinolin-5-yloxymethyl)-1,2-oxazol-3-yl]methanone

Systemtic Name: (4-cyclopentylpiperazin-4-ium-1-yl)-[5-(isoquinolin-5-yloxymethyl)-1,2-oxazol-3-yl]methanone Openeye Name: (4-cyclopentylpiperazin-4-ium-1-yl)-[5-(5-isoquinolyloxymethyl)isoxazol-3-yl]methanone CAS Name: (4-cyclopentyl-1-piperazin-4-iumyl)-[5-(5-isoquinolinyloxymethyl)-3-isoxazolyl]methanone IUPAC Name: (4-cyclopentylpiperazin-4-ium-1-yl)-[5-(isoquinolin-5-yloxymethyl)-1,2-oxazol-3-yl]methanone Traditional Name: (4-cyclopentylpiperazin-4-ium-1-yl)-[5-(5-isoquinolyloxymethyl)isoxazol-3-yl]methanone Formula: C23H27N4O3+ MolecularWeight: 407.48548

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)[NH+]2CCN(CC2)C(=O)C3=NOC(=C3)COC4=CC=CC5=C4C=CN=C5

Isomeric SMILES

C1CCC(C1)[NH+]2CCN(CC2)C(=O)C3=NOC(=C3)COC4=CC=CC5=C4C=CN=C5

InChI

InChI=1S/C23H26N4O3/c28-23(27-12-10-26(11-13-27)18-5-1-2-6-18)21-14-19(30-25-21)16-29-22-7-3-4-17-15-24-9-8-20(17)22/h3-4,7-9,14-15,18H,1-2,5-6,10-13,16H2/p+1