3-[[1-[2,6-bis(oxidanylidene)-4-phenyl-cyclohexylidene]-2-naphthalen-1-yl-ethyl]amino]propanoic acid

Systemtic Name: 3-[[1-[2,6-bis(oxidanylidene)-4-phenyl-cyclohexylidene]-2-naphthalen-1-yl-ethyl]amino]propanoic acid Openeye Name: 3-[[1-(2,6-dioxo-4-phenyl-cyclohexylidene)-2-(1-naphthyl)ethyl]amino]propanoic acid CAS Name: 3-[[1-(2,6-dioxo-4-phenylcyclohexylidene)-2-(1-naphthalenyl)ethyl]amino]propanoic acid IUPAC Name: 3-[[1-(2,6-dioxo-4-phenylcyclohexylidene)-2-naphthalen-1-ylethyl]amino]propanoic acid Traditional Name: 3-[[1-(2,6-diketo-4-phenyl-cyclohexylidene)-2-(1-naphthyl)ethyl]amino]propionic acid Formula: C27H25NO4 MolecularWeight: 427.4917

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CC(=O)C(=C(CC2=CC=CC3=CC=CC=C32)NCCC(=O)O)C1=O)C4=CC=CC=C4

Isomeric SMILES

C1C(CC(=O)C(=C(CC2=CC=CC3=CC=CC=C32)NCCC(=O)O)C1=O)C4=CC=CC=C4

InChI

InChI=1S/C27H25NO4/c29-24-16-21(18-7-2-1-3-8-18)17-25(30)27(24)23(28-14-13-26(31)32)15-20-11-6-10-19-9-4-5-12-22(19)20/h1-12,21,28H,13-17H2,(H,31,32)