[2-(cyclohexylcarbamoylamino)-2-oxidanylidene-ethyl] (E)-3-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)prop-2-enoate

Systemtic Name: [2-(cyclohexylcarbamoylamino)-2-oxidanylidene-ethyl] (E)-3-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)prop-2-enoate Openeye Name: [2-(cyclohexylcarbamoylamino)-2-oxo-ethyl] (E)-3-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)prop-2-enoate CAS Name: (E)-3-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)-2-propenoic acid [2-[[(cyclohexylamino)-oxomethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-(cyclohexylcarbamoylamino)-2-oxoethyl] (E)-3-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)prop-2-enoate Traditional Name: (E)-3-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)acrylic acid [2-(cyclohexylcarbamoylamino)-2-keto-ethyl] ester Formula: C21H26N2O7 MolecularWeight: 418.44034

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC2=C1OCCO2)C=CC(=O)OCC(=O)NC(=O)NC3CCCCC3

Isomeric SMILES

COC1=CC(=CC2=C1OCCO2)/C=C/C(=O)OCC(=O)NC(=O)NC3CCCCC3

InChI

InChI=1S/C21H26N2O7/c1-27-16-11-14(12-17-20(16)29-10-9-28-17)7-8-19(25)30-13-18(24)23-21(26)22-15-5-3-2-4-6-15/h7-8,11-12,15H,2-6,9-10,13H2,1H3,(H2,22,23,24,26)/b8-7+