[1-(cyclohexylmethylamino)-1-oxidanylidene-propan-2-yl] (E)-3-(3-chloranyl-4,5-dimethoxy-phenyl)prop-2-enoate

Systemtic Name: [1-(cyclohexylmethylamino)-1-oxidanylidene-propan-2-yl] (E)-3-(3-chloranyl-4,5-dimethoxy-phenyl)prop-2-enoate Openeye Name: [2-(cyclohexylmethylamino)-1-methyl-2-oxo-ethyl] (E)-3-(3-chloro-4,5-dimethoxy-phenyl)prop-2-enoate CAS Name: (E)-3-(3-chloro-4,5-dimethoxyphenyl)-2-propenoic acid [1-(cyclohexylmethylamino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(cyclohexylmethylamino)-1-oxopropan-2-yl] (E)-3-(3-chloro-4,5-dimethoxyphenyl)prop-2-enoate Traditional Name: (E)-3-(3-chloro-4,5-dimethoxy-phenyl)acrylic acid [2-(cyclohexylmethylamino)-2-keto-1-methyl-ethyl] ester Formula: C21H28ClNO5 MolecularWeight: 409.90372

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1CCCCC1)OC(=O)C=CC2=CC(=C(C(=C2)Cl)OC)OC

Isomeric SMILES

CC(C(=O)NCC1CCCCC1)OC(=O)/C=C/C2=CC(=C(C(=C2)Cl)OC)OC

InChI

InChI=1S/C21H28ClNO5/c1-14(21(25)23-13-15-7-5-4-6-8-15)28-19(24)10-9-16-11-17(22)20(27-3)18(12-16)26-2/h9-12,14-15H,4-8,13H2,1-3H3,(H,23,25)/b10-9+