2-[[5,5-dimethyl-2-(2-naphthalen-1-ylethanoyl)-3-oxidanylidene-cyclohexen-1-yl]amino]propanoic acid

Systemtic Name: 2-[[5,5-dimethyl-2-(2-naphthalen-1-ylethanoyl)-3-oxidanylidene-cyclohexen-1-yl]amino]propanoic acid Openeye Name: 2-[[5,5-dimethyl-2-[2-(1-naphthyl)acetyl]-3-oxo-cyclohexen-1-yl]amino]propanoic acid CAS Name: 2-[[5,5-dimethyl-2-[2-(1-naphthalenyl)-1-oxoethyl]-3-oxo-1-cyclohexenyl]amino]propanoic acid IUPAC Name: 2-[[5,5-dimethyl-2-(2-naphthalen-1-ylacetyl)-3-oxocyclohexen-1-yl]amino]propanoic acid Traditional Name: 2-[[3-keto-5,5-dimethyl-2-[2-(1-naphthyl)acetyl]cyclohexen-1-yl]amino]propionic acid Formula: C23H25NO4 MolecularWeight: 379.4489

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)NC1=C(C(=O)CC(C1)(C)C)C(=O)CC2=CC=CC3=CC=CC=C32

Isomeric SMILES

CC(C(=O)O)NC1=C(C(=O)CC(C1)(C)C)C(=O)CC2=CC=CC3=CC=CC=C32

InChI

InChI=1S/C23H25NO4/c1-14(22(27)28)24-18-12-23(2,3)13-20(26)21(18)19(25)11-16-9-6-8-15-7-4-5-10-17(15)16/h4-10,14,24H,11-13H2,1-3H3,(H,27,28)