2-[3-(benzotriazol-2-yl)-4-cyclohexylcarbonyl-phenyl]ethyl 2-methylprop-2-enoate

Systemtic Name: 2-[3-(benzotriazol-2-yl)-4-cyclohexylcarbonyl-phenyl]ethyl 2-methylprop-2-enoate Openeye Name: 2-[3-(benzotriazol-2-yl)-4-(cyclohexanecarbonyl)phenyl]ethyl 2-methylprop-2-enoate CAS Name: 2-methyl-2-propenoic acid 2-[3-(2-benzotriazolyl)-4-[cyclohexyl(oxo)methyl]phenyl]ethyl ester IUPAC Name: 2-[3-(benzotriazol-2-yl)-4-(cyclohexanecarbonyl)phenyl]ethyl 2-methylprop-2-enoate Traditional Name: 2-methylacrylic acid 2-[3-(benzotriazol-2-yl)-4-(cyclohexanecarbonyl)phenyl]ethyl ester Formula: C25H27N3O3 MolecularWeight: 417.50018

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C(=O)OCCC1=CC(=C(C=C1)C(=O)C2CCCCC2)N3N=C4C=CC=CC4=N3

Isomeric SMILES

CC(=C)C(=O)OCCC1=CC(=C(C=C1)C(=O)C2CCCCC2)N3N=C4C=CC=CC4=N3

InChI

InChI=1S/C25H27N3O3/c1-17(2)25(30)31-15-14-18-12-13-20(24(29)19-8-4-3-5-9-19)23(16-18)28-26-21-10-6-7-11-22(21)27-28/h6-7,10-13,16,19H,1,3-5,8-9,14-15H2,2H3