2-[4-(2-cyanoethyl)piperazin-1-yl]-2-(2-phenyl-1H-indol-3-yl)ethanoic acid

Systemtic Name: 2-[4-(2-cyanoethyl)piperazin-1-yl]-2-(2-phenyl-1H-indol-3-yl)ethanoic acid Openeye Name: 2-[4-(2-cyanoethyl)piperazin-1-yl]-2-(2-phenyl-1H-indol-3-yl)acetic acid CAS Name: 2-[4-(2-cyanoethyl)-1-piperazinyl]-2-(2-phenyl-1H-indol-3-yl)acetic acid IUPAC Name: 2-[4-(2-cyanoethyl)piperazin-1-yl]-2-(2-phenyl-1H-indol-3-yl)acetic acid Traditional Name: 2-[4-(2-cyanoethyl)piperazino]-2-(2-phenyl-1H-indol-3-yl)acetic acid Formula: C23H24N4O2 MolecularWeight: 388.46226

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC#N)C(C2=C(NC3=CC=CC=C32)C4=CC=CC=C4)C(=O)O

Isomeric SMILES

C1CN(CCN1CCC#N)C(C2=C(NC3=CC=CC=C32)C4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C23H24N4O2/c24-11-6-12-26-13-15-27(16-14-26)22(23(28)29)20-18-9-4-5-10-19(18)25-21(20)17-7-2-1-3-8-17/h1-5,7-10,22,25H,6,12-16H2,(H,28,29)