N-[4-[2-(1-adamantylamino)-2-oxidanylidene-ethoxy]-3-ethanoyl-phenyl]butanamide

Systemtic Name: N-[4-[2-(1-adamantylamino)-2-oxidanylidene-ethoxy]-3-ethanoyl-phenyl]butanamide Openeye Name: N-[3-acetyl-4-[2-(1-adamantylamino)-2-oxo-ethoxy]phenyl]butanamide CAS Name: N-[3-acetyl-4-[2-(1-adamantylamino)-2-oxoethoxy]phenyl]butanamide IUPAC Name: N-[3-acetyl-4-[2-(1-adamantylamino)-2-oxoethoxy]phenyl]butanamide Traditional Name: N-[3-acetyl-4-[2-(1-adamantylamino)-2-keto-ethoxy]phenyl]butyramide Formula: C24H32N2O4 MolecularWeight: 412.52188

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=CC(=C(C=C1)OCC(=O)NC23CC4CC(C2)CC(C4)C3)C(=O)C

Isomeric SMILES

CCCC(=O)NC1=CC(=C(C=C1)OCC(=O)NC23CC4CC(C2)CC(C4)C3)C(=O)C

InChI

InChI=1S/C24H32N2O4/c1-3-4-22(28)25-19-5-6-21(20(10-19)15(2)27)30-14-23(29)26-24-11-16-7-17(12-24)9-18(8-16)13-24/h5-6,10,16-18H,3-4,7-9,11-14H2,1-2H3,(H,25,28)(H,26,29)