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(E)-1-(4-chlorophenyl)-3-[(2-ethyl-6-methyl-phenyl)amino]but-2-en-1-one
(E)-1-(4-chlorophenyl)-3-[(2-ethyl-6-methyl-phenyl)amino]but-2-en-1-one
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Descriptors Computed from Structure
Canonical SMILES:
CCC1=CC=CC(=C1NC(=CC(=O)C2=CC=C(C=C2)Cl)C)C
Isomeric SMILES
CCC1=CC=CC(=C1N/C(=C/C(=O)C2=CC=C(C=C2)Cl)/C)C
InChI
InChI=1S/C19H20ClNO/c1-4-15-7-5-6-13(2)19(15)21-14(3)12-18(22)16-8-10-17(20)11-9-16/h5-12,21H,4H2,1-3H3/b14-12+
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- (2R)-2-phenyl-1-(pyridin-3-ylmethylamino)propan-2-ol
- (Z)-1-(4-chlorophenyl)-3-[(3-methylpyridin-1-ium-2-yl)amino]but-2-en-1-one
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