2-[[(4-cyclooctylphenyl)amino]methylidene]propanedioic acid

Systemtic Name: 2-[[(4-cyclooctylphenyl)amino]methylidene]propanedioic acid Openeye Name: 2-[(4-cyclooctylanilino)methylene]propanedioic acid CAS Name: 2-[(4-cyclooctylanilino)methylidene]propanedioic acid IUPAC Name: 2-[(4-cyclooctylanilino)methylidene]propanedioic acid Traditional Name: 2-[(4-cyclooctylanilino)methylene]malonic acid Formula: C18H23NO4 MolecularWeight: 317.37952

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CCC1)C2=CC=C(C=C2)NC=C(C(=O)O)C(=O)O

Isomeric SMILES

C1CCCC(CCC1)C2=CC=C(C=C2)NC=C(C(=O)O)C(=O)O

InChI

InChI=1S/C18H23NO4/c20-17(21)16(18(22)23)12-19-15-10-8-14(9-11-15)13-6-4-2-1-3-5-7-13/h8-13,19H,1-7H2,(H,20,21)(H,22,23)