ethyl (E)-3-[4-[2-(1-adamantylcarbonylamino)ethanoylamino]phenyl]prop-2-enoate

Systemtic Name: ethyl (E)-3-[4-[2-(1-adamantylcarbonylamino)ethanoylamino]phenyl]prop-2-enoate Openeye Name: ethyl (E)-3-[4-[[2-(adamantane-1-carbonylamino)acetyl]amino]phenyl]prop-2-enoate CAS Name: (E)-3-[4-[[2-[[1-adamantyl(oxo)methyl]amino]-1-oxoethyl]amino]phenyl]-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-[4-[[2-(adamantane-1-carbonylamino)acetyl]amino]phenyl]prop-2-enoate Traditional Name: (E)-3-[4-[[2-(adamantane-1-carbonylamino)acetyl]amino]phenyl]acrylic acid ethyl ester Formula: C24H30N2O4 MolecularWeight: 410.506

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC1=CC=C(C=C1)NC(=O)CNC(=O)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CCOC(=O)/C=C/C1=CC=C(C=C1)NC(=O)CNC(=O)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C24H30N2O4/c1-2-30-22(28)8-5-16-3-6-20(7-4-16)26-21(27)15-25-23(29)24-12-17-9-18(13-24)11-19(10-17)14-24/h3-8,17-19H,2,9-15H2,1H3,(H,25,29)(H,26,27)/b8-5+