N-[4-[(E)-3-(dimethylamino)prop-2-enoyl]phenyl]-2-(2-phenyl-2-adamantyl)ethanamide

Systemtic Name: N-[4-[(E)-3-(dimethylamino)prop-2-enoyl]phenyl]-2-(2-phenyl-2-adamantyl)ethanamide Openeye Name: N-[4-[(E)-3-(dimethylamino)prop-2-enoyl]phenyl]-2-(2-phenyl-2-adamantyl)acetamide CAS Name: N-[4-[(E)-3-(dimethylamino)-1-oxoprop-2-enyl]phenyl]-2-(2-phenyl-2-adamantyl)acetamide IUPAC Name: N-[4-[(E)-3-(dimethylamino)prop-2-enoyl]phenyl]-2-(2-phenyl-2-adamantyl)acetamide Traditional Name: N-[4-[(E)-3-(dimethylamino)acryloyl]phenyl]-2-(2-phenyl-2-adamantyl)acetamide Formula: C29H34N2O2 MolecularWeight: 442.59246

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C=CC(=O)C1=CC=C(C=C1)NC(=O)CC2(C3CC4CC(C3)CC2C4)C5=CC=CC=C5

Isomeric SMILES

CN(C)/C=C/C(=O)C1=CC=C(C=C1)NC(=O)CC2(C3CC4CC(C3)CC2C4)C5=CC=CC=C5

InChI

InChI=1S/C29H34N2O2/c1-31(2)13-12-27(32)22-8-10-26(11-9-22)30-28(33)19-29(23-6-4-3-5-7-23)24-15-20-14-21(17-24)18-25(29)16-20/h3-13,20-21,24-25H,14-19H2,1-2H3,(H,30,33)/b13-12+