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

Systemtic Name: 2-[[5,5-dimethyl-2-(2-naphthalen-1-ylethanoyl)-3-oxidanylidene-cyclohexen-1-yl]amino]ethanoic acid Openeye Name: 2-[[5,5-dimethyl-2-[2-(1-naphthyl)acetyl]-3-oxo-cyclohexen-1-yl]amino]acetic acid CAS Name: 2-[[5,5-dimethyl-2-[2-(1-naphthalenyl)-1-oxoethyl]-3-oxo-1-cyclohexenyl]amino]acetic acid IUPAC Name: 2-[[5,5-dimethyl-2-(2-naphthalen-1-ylacetyl)-3-oxocyclohexen-1-yl]amino]acetic acid Traditional Name: 2-[[3-keto-5,5-dimethyl-2-[2-(1-naphthyl)acetyl]cyclohexen-1-yl]amino]acetic acid Formula: C22H23NO4 MolecularWeight: 365.42232

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=C(C(=O)C1)C(=O)CC2=CC=CC3=CC=CC=C32)NCC(=O)O)C

Isomeric SMILES

CC1(CC(=C(C(=O)C1)C(=O)CC2=CC=CC3=CC=CC=C32)NCC(=O)O)C

InChI

InChI=1S/C22H23NO4/c1-22(2)11-17(23-13-20(26)27)21(19(25)12-22)18(24)10-15-8-5-7-14-6-3-4-9-16(14)15/h3-9,23H,10-13H2,1-2H3,(H,26,27)