1-[4-[3-[4-(6-fluoranyl-1,2-benzoxazol-3-yl)piperidin-1-yl]propoxy]-3-methoxy-phenyl]pentan-1-one

Systemtic Name: 1-[4-[3-[4-(6-fluoranyl-1,2-benzoxazol-3-yl)piperidin-1-yl]propoxy]-3-methoxy-phenyl]pentan-1-one Openeye Name: 1-[4-[3-[4-(6-fluoro-1,2-benzoxazol-3-yl)-1-piperidyl]propoxy]-3-methoxy-phenyl]pentan-1-one CAS Name: 1-[4-[3-[4-(6-fluoro-1,2-benzoxazol-3-yl)-1-piperidinyl]propoxy]-3-methoxyphenyl]-1-pentanone IUPAC Name: 1-[4-[3-[4-(6-fluoro-1,2-benzoxazol-3-yl)piperidin-1-yl]propoxy]-3-methoxyphenyl]pentan-1-one Traditional Name: 1-[4-[3-[4-(6-fluoroindoxazen-3-yl)piperidino]propoxy]-3-methoxy-phenyl]pentan-1-one Formula: C27H33FN2O4 MolecularWeight: 468.560323

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)C1=CC(=C(C=C1)OCCCN2CCC(CC2)C3=NOC4=C3C=CC(=C4)F)OC

Isomeric SMILES

CCCCC(=O)C1=CC(=C(C=C1)OCCCN2CCC(CC2)C3=NOC4=C3C=CC(=C4)F)OC

InChI

InChI=1S/C27H33FN2O4/c1-3-4-6-23(31)20-7-10-24(26(17-20)32-2)33-16-5-13-30-14-11-19(12-15-30)27-22-9-8-21(28)18-25(22)34-29-27/h7-10,17-19H,3-6,11-16H2,1-2H3