2-[(5-ethyl-1H-indol-3-yl)methyl]propanedioic acid

Systemtic Name: 2-[(5-ethyl-1H-indol-3-yl)methyl]propanedioic acid Openeye Name: 2-[(5-ethyl-1H-indol-3-yl)methyl]propanedioic acid CAS Name: 2-[(5-ethyl-1H-indol-3-yl)methyl]propanedioic acid IUPAC Name: 2-[(5-ethyl-1H-indol-3-yl)methyl]propanedioic acid Traditional Name: 2-[(5-ethyl-1H-indol-3-yl)methyl]malonic acid Formula: C14H15NO4 MolecularWeight: 261.2732

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)NC=C2CC(C(=O)O)C(=O)O

Isomeric SMILES

CCC1=CC2=C(C=C1)NC=C2CC(C(=O)O)C(=O)O

InChI

InChI=1S/C14H15NO4/c1-2-8-3-4-12-10(5-8)9(7-15-12)6-11(13(16)17)14(18)19/h3-5,7,11,15H,2,6H2,1H3,(H,16,17)(H,18,19)