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

Systemtic Name: 2-[[2-(2-naphthalen-1-ylethanoyl)-3-oxidanylidene-5-phenyl-cyclohexen-1-yl]amino]propanoic acid Openeye Name: 2-[[2-[2-(1-naphthyl)acetyl]-3-oxo-5-phenyl-cyclohexen-1-yl]amino]propanoic acid CAS Name: 2-[[2-[2-(1-naphthalenyl)-1-oxoethyl]-3-oxo-5-phenyl-1-cyclohexenyl]amino]propanoic acid IUPAC Name: 2-[[2-(2-naphthalen-1-ylacetyl)-3-oxo-5-phenylcyclohexen-1-yl]amino]propanoic acid Traditional Name: 2-[[3-keto-2-[2-(1-naphthyl)acetyl]-5-phenyl-cyclohexen-1-yl]amino]propionic acid Formula: C27H25NO4 MolecularWeight: 427.4917

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)NC1=C(C(=O)CC(C1)C2=CC=CC=C2)C(=O)CC3=CC=CC4=CC=CC=C43

Isomeric SMILES

CC(C(=O)O)NC1=C(C(=O)CC(C1)C2=CC=CC=C2)C(=O)CC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C27H25NO4/c1-17(27(31)32)28-23-14-21(18-8-3-2-4-9-18)16-25(30)26(23)24(29)15-20-12-7-11-19-10-5-6-13-22(19)20/h2-13,17,21,28H,14-16H2,1H3,(H,31,32)