(E)-3-(2-azanylethylamino)-3-(tert-butylamino)-1-(4-methylphenyl)prop-2-en-1-one

Systemtic Name: (E)-3-(2-azanylethylamino)-3-(tert-butylamino)-1-(4-methylphenyl)prop-2-en-1-one Openeye Name: (E)-3-(2-aminoethylamino)-3-(tert-butylamino)-1-(p-tolyl)prop-2-en-1-one CAS Name: (E)-3-(2-aminoethylamino)-3-(tert-butylamino)-1-(4-methylphenyl)-2-propen-1-one IUPAC Name: (E)-3-(2-aminoethylamino)-3-(tert-butylamino)-1-(4-methylphenyl)prop-2-en-1-one Traditional Name: (E)-3-(2-aminoethylamino)-3-(tert-butylamino)-1-(p-tolyl)prop-2-en-1-one Formula: C16H25N3O MolecularWeight: 275.3892

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C=C(NCCN)NC(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)/C=C(\NCCN)/NC(C)(C)C

InChI

InChI=1S/C16H25N3O/c1-12-5-7-13(8-6-12)14(20)11-15(18-10-9-17)19-16(2,3)4/h5-8,11,18-19H,9-10,17H2,1-4H3/b15-11+