3-[1-(5-butoxy-6-methoxy-cyclohexa-1,5-dien-1-yl)piperidin-4-yl]-6-fluoranyl-2H-indazole

Systemtic Name: 3-[1-(5-butoxy-6-methoxy-cyclohexa-1,5-dien-1-yl)piperidin-4-yl]-6-fluoranyl-2H-indazole Openeye Name: 3-[1-(5-butoxy-6-methoxy-cyclohexa-1,5-dien-1-yl)-4-piperidyl]-6-fluoro-2H-indazole CAS Name: 3-[1-(5-butoxy-6-methoxy-1-cyclohexa-1,5-dienyl)-4-piperidinyl]-6-fluoro-2H-indazole IUPAC Name: 3-[1-(5-butoxy-6-methoxycyclohexa-1,5-dien-1-yl)piperidin-4-yl]-6-fluoro-2H-indazole Traditional Name: 3-[1-(5-butoxy-6-methoxy-cyclohexa-1,5-dien-1-yl)-4-piperidyl]-6-fluoro-2H-indazole Formula: C23H30FN3O2 MolecularWeight: 399.501603

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C(=CCC1)N2CCC(CC2)C3=C4C=CC(=CC4=NN3)F)OC

Isomeric SMILES

CCCCOC1=C(C(=CCC1)N2CCC(CC2)C3=C4C=CC(=CC4=NN3)F)OC

InChI

InChI=1S/C23H30FN3O2/c1-3-4-14-29-21-7-5-6-20(23(21)28-2)27-12-10-16(11-13-27)22-18-9-8-17(24)15-19(18)25-26-22/h6,8-9,15-16H,3-5,7,10-14H2,1-2H3,(H,25,26)