(E)-N-(1-adamantyl)-3-[4-(2-azanyl-2-oxidanylidene-ethoxy)-3-methoxy-phenyl]prop-2-enamide

Systemtic Name: (E)-N-(1-adamantyl)-3-[4-(2-azanyl-2-oxidanylidene-ethoxy)-3-methoxy-phenyl]prop-2-enamide Openeye Name: (E)-N-(1-adamantyl)-3-[4-(2-amino-2-oxo-ethoxy)-3-methoxy-phenyl]prop-2-enamide CAS Name: (E)-N-(1-adamantyl)-3-[4-(2-amino-2-oxoethoxy)-3-methoxyphenyl]-2-propenamide IUPAC Name: (E)-N-(1-adamantyl)-3-[4-(2-amino-2-oxoethoxy)-3-methoxyphenyl]prop-2-enamide Traditional Name: (E)-N-(1-adamantyl)-3-[4-(2-amino-2-keto-ethoxy)-3-methoxy-phenyl]acrylamide Formula: C22H28N2O4 MolecularWeight: 384.46872

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=CC(=O)NC23CC4CC(C2)CC(C4)C3)OCC(=O)N

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C/C(=O)NC23CC4CC(C2)CC(C4)C3)OCC(=O)N

InChI

InChI=1S/C22H28N2O4/c1-27-19-9-14(2-4-18(19)28-13-20(23)25)3-5-21(26)24-22-10-15-6-16(11-22)8-17(7-15)12-22/h2-5,9,15-17H,6-8,10-13H2,1H3,(H2,23,25)(H,24,26)/b5-3+