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

Systemtic Name: [1-(cyclohexylcarbamoylamino)-1-oxidanylidene-propan-2-yl] (E)-3-(3-chloranyl-4,5-dimethoxy-phenyl)prop-2-enoate Openeye Name: [2-(cyclohexylcarbamoylamino)-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-[[(cyclohexylamino)-oxomethyl]amino]-1-oxopropan-2-yl] ester IUPAC Name: [1-(cyclohexylcarbamoylamino)-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-(cyclohexylcarbamoylamino)-2-keto-1-methyl-ethyl] ester Formula: C21H27ClN2O6 MolecularWeight: 438.90188

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)NC1CCCCC1)OC(=O)C=CC2=CC(=C(C(=C2)Cl)OC)OC

Isomeric SMILES

CC(C(=O)NC(=O)NC1CCCCC1)OC(=O)/C=C/C2=CC(=C(C(=C2)Cl)OC)OC

InChI

InChI=1S/C21H27ClN2O6/c1-13(20(26)24-21(27)23-15-7-5-4-6-8-15)30-18(25)10-9-14-11-16(22)19(29-3)17(12-14)28-2/h9-13,15H,4-8H2,1-3H3,(H2,23,24,26,27)/b10-9+