N-cyclohexyl-N-(2-morpholin-4-ylethoxy)-7-[[(E)-3-pyridin-3-ylprop-2-enoyl]amino]heptanamide

Systemtic Name: N-cyclohexyl-N-(2-morpholin-4-ylethoxy)-7-[[(E)-3-pyridin-3-ylprop-2-enoyl]amino]heptanamide Openeye Name: N-cyclohexyl-N-(2-morpholinoethoxy)-7-[[(E)-3-(3-pyridyl)prop-2-enoyl]amino]heptanamide CAS Name: N-cyclohexyl-N-[2-(4-morpholinyl)ethoxy]-7-[[(E)-1-oxo-3-(3-pyridinyl)prop-2-enyl]amino]heptanamide IUPAC Name: N-cyclohexyl-N-(2-morpholin-4-ylethoxy)-7-[[(E)-3-pyridin-3-ylprop-2-enoyl]amino]heptanamide Traditional Name: N-cyclohexyl-N-(2-morpholinoethoxy)-7-[[(E)-3-(3-pyridyl)acryloyl]amino]enanthamide Formula: C27H42N4O4 MolecularWeight: 486.64678

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N(C(=O)CCCCCCNC(=O)C=CC2=CN=CC=C2)OCCN3CCOCC3

Isomeric SMILES

C1CCC(CC1)N(C(=O)CCCCCCNC(=O)/C=C/C2=CN=CC=C2)OCCN3CCOCC3

InChI

InChI=1S/C27H42N4O4/c32-26(14-13-24-9-8-15-28-23-24)29-16-7-2-1-6-12-27(33)31(25-10-4-3-5-11-25)35-22-19-30-17-20-34-21-18-30/h8-9,13-15,23,25H,1-7,10-12,16-22H2,(H,29,32)/b14-13+