N-[2-[(3,4-dipropoxyphenyl)amino]-2-oxidanylidene-ethyl]adamantane-1-carboxamide

Systemtic Name: N-[2-[(3,4-dipropoxyphenyl)amino]-2-oxidanylidene-ethyl]adamantane-1-carboxamide Openeye Name: N-[2-(3,4-dipropoxyanilino)-2-oxo-ethyl]adamantane-1-carboxamide CAS Name: N-[2-(3,4-dipropoxyanilino)-2-oxoethyl]-1-adamantanecarboxamide IUPAC Name: N-[2-(3,4-dipropoxyanilino)-2-oxoethyl]adamantane-1-carboxamide Traditional Name: N-[2-(3,4-dipropoxyanilino)-2-keto-ethyl]adamantane-1-carboxamide Formula: C25H36N2O4 MolecularWeight: 428.56434

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)NC(=O)CNC(=O)C23CC4CC(C2)CC(C4)C3)OCCC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)NC(=O)CNC(=O)C23CC4CC(C2)CC(C4)C3)OCCC

InChI

InChI=1S/C25H36N2O4/c1-3-7-30-21-6-5-20(12-22(21)31-8-4-2)27-23(28)16-26-24(29)25-13-17-9-18(14-25)11-19(10-17)15-25/h5-6,12,17-19H,3-4,7-11,13-16H2,1-2H3,(H,26,29)(H,27,28)