3-[1-(2-benzamido-4-oxidanylidene-6-phenyl-hexanoyl)oxycyclohexyl]propanoic acid

Systemtic Name: 3-[1-(2-benzamido-4-oxidanylidene-6-phenyl-hexanoyl)oxycyclohexyl]propanoic acid Openeye Name: 3-[1-(2-benzamido-4-oxo-6-phenyl-hexanoyl)oxycyclohexyl]propanoic acid CAS Name: 3-[1-(2-benzamido-1,4-dioxo-6-phenylhexoxy)cyclohexyl]propanoic acid IUPAC Name: 3-[1-(2-benzamido-4-oxo-6-phenylhexanoyl)oxycyclohexyl]propanoic acid Traditional Name: 3-[1-(2-benzamido-4-keto-6-phenyl-hexanoyl)oxycyclohexyl]propionic acid Formula: C28H33NO6 MolecularWeight: 479.56472

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(CCC(=O)O)OC(=O)C(CC(=O)CCC2=CC=CC=C2)NC(=O)C3=CC=CC=C3

Isomeric SMILES

C1CCC(CC1)(CCC(=O)O)OC(=O)C(CC(=O)CCC2=CC=CC=C2)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C28H33NO6/c30-23(15-14-21-10-4-1-5-11-21)20-24(29-26(33)22-12-6-2-7-13-22)27(34)35-28(19-16-25(31)32)17-8-3-9-18-28/h1-2,4-7,10-13,24H,3,8-9,14-20H2,(H,29,33)(H,31,32)