3-[1-(5-butan-2-yloxy-6-methoxy-cyclohexa-1,5-dien-1-yl)piperidin-4-yl]-6-fluoranyl-1,2-benzoxazole

Systemtic Name: 3-[1-(5-butan-2-yloxy-6-methoxy-cyclohexa-1,5-dien-1-yl)piperidin-4-yl]-6-fluoranyl-1,2-benzoxazole Openeye Name: 6-fluoro-3-[1-(6-methoxy-5-sec-butoxy-cyclohexa-1,5-dien-1-yl)-4-piperidyl]-1,2-benzoxazole CAS Name: 3-[1-(5-butan-2-yloxy-6-methoxy-1-cyclohexa-1,5-dienyl)-4-piperidinyl]-6-fluoro-1,2-benzoxazole IUPAC Name: 3-[1-(5-butan-2-yloxy-6-methoxycyclohexa-1,5-dien-1-yl)piperidin-4-yl]-6-fluoro-1,2-benzoxazole Traditional Name: 6-fluoro-3-[1-(6-methoxy-5-sec-butoxy-cyclohexa-1,5-dien-1-yl)-4-piperidyl]indoxazene Formula: C23H29FN2O3 MolecularWeight: 400.486363

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OC1=C(C(=CCC1)N2CCC(CC2)C3=NOC4=C3C=CC(=C4)F)OC

Isomeric SMILES

CCC(C)OC1=C(C(=CCC1)N2CCC(CC2)C3=NOC4=C3C=CC(=C4)F)OC

InChI

InChI=1S/C23H29FN2O3/c1-4-15(2)28-20-7-5-6-19(23(20)27-3)26-12-10-16(11-13-26)22-18-9-8-17(24)14-21(18)29-25-22/h6,8-9,14-16H,4-5,7,10-13H2,1-3H3