[2-(4-fluorophenyl)-1,3-thiazol-4-yl]methyl (E)-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)prop-2-enoate

Systemtic Name: [2-(4-fluorophenyl)-1,3-thiazol-4-yl]methyl (E)-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)prop-2-enoate Openeye Name: [2-(4-fluorophenyl)thiazol-4-yl]methyl (E)-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)prop-2-enoate CAS Name: (E)-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-propenoic acid [2-(4-fluorophenyl)-4-thiazolyl]methyl ester IUPAC Name: [2-(4-fluorophenyl)-1,3-thiazol-4-yl]methyl (E)-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)prop-2-enoate Traditional Name: (E)-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)acrylic acid [2-(4-fluorophenyl)thiazol-4-yl]methyl ester Formula: C22H18FNO4S MolecularWeight: 411.446023

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)C=CC(=O)OCC3=CSC(=N3)C4=CC=C(C=C4)F)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)/C=C/C(=O)OCC3=CSC(=N3)C4=CC=C(C=C4)F)OC1

InChI

InChI=1S/C22H18FNO4S/c23-17-6-4-16(5-7-17)22-24-18(14-29-22)13-28-21(25)9-3-15-2-8-19-20(12-15)27-11-1-10-26-19/h2-9,12,14H,1,10-11,13H2/b9-3+