3-[4-(6-oxidanylideneheptanoylamino)phenyl]propanoic acid

Systemtic Name: 3-[4-(6-oxidanylideneheptanoylamino)phenyl]propanoic acid Openeye Name: 3-[4-(6-oxoheptanoylamino)phenyl]propanoic acid CAS Name: 3-[4-(1,6-dioxoheptylamino)phenyl]propanoic acid IUPAC Name: 3-[4-(6-oxoheptanoylamino)phenyl]propanoic acid Traditional Name: 3-[4-(6-ketoheptanoylamino)phenyl]propionic acid Formula: C16H21NO4 MolecularWeight: 291.34224

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCCCC(=O)NC1=CC=C(C=C1)CCC(=O)O

Isomeric SMILES

CC(=O)CCCCC(=O)NC1=CC=C(C=C1)CCC(=O)O

InChI

InChI=1S/C16H21NO4/c1-12(18)4-2-3-5-15(19)17-14-9-6-13(7-10-14)8-11-16(20)21/h6-7,9-10H,2-5,8,11H2,1H3,(H,17,19)(H,20,21)