1-[3-[4-(6-fluoranyl-1,2-benzoxazol-3-yl)piperidin-1-yl]propoxy]-5-methoxy-cyclohexa-2,4-diene-1-carbonitrile

Systemtic Name: 1-[3-[4-(6-fluoranyl-1,2-benzoxazol-3-yl)piperidin-1-yl]propoxy]-5-methoxy-cyclohexa-2,4-diene-1-carbonitrile Openeye Name: 1-[3-[4-(6-fluoro-1,2-benzoxazol-3-yl)-1-piperidyl]propoxy]-5-methoxy-cyclohexa-2,4-diene-1-carbonitrile CAS Name: 1-[3-[4-(6-fluoro-1,2-benzoxazol-3-yl)-1-piperidinyl]propoxy]-5-methoxy-1-cyclohexa-2,4-dienecarbonitrile IUPAC Name: 1-[3-[4-(6-fluoro-1,2-benzoxazol-3-yl)piperidin-1-yl]propoxy]-5-methoxycyclohexa-2,4-diene-1-carbonitrile Traditional Name: 1-[3-[4-(6-fluoroindoxazen-3-yl)piperidino]propoxy]-5-methoxy-cyclohexa-2,4-diene-1-carbonitrile Formula: C23H26FN3O3 MolecularWeight: 411.469243

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(C1)(C#N)OCCCN2CCC(CC2)C3=NOC4=C3C=CC(=C4)F

Isomeric SMILES

COC1=CC=CC(C1)(C#N)OCCCN2CCC(CC2)C3=NOC4=C3C=CC(=C4)F

InChI

InChI=1S/C23H26FN3O3/c1-28-19-4-2-9-23(15-19,16-25)29-13-3-10-27-11-7-17(8-12-27)22-20-6-5-18(24)14-21(20)30-26-22/h2,4-6,9,14,17H,3,7-8,10-13,15H2,1H3