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

Systemtic Name: 2-(1H-indol-3-yl)-2-[4-(3-methoxyphenyl)piperazin-1-yl]ethanoic acid Openeye Name: 2-(1H-indol-3-yl)-2-[4-(3-methoxyphenyl)piperazin-1-yl]acetic acid CAS Name: 2-(1H-indol-3-yl)-2-[4-(3-methoxyphenyl)-1-piperazinyl]acetic acid IUPAC Name: 2-(1H-indol-3-yl)-2-[4-(3-methoxyphenyl)piperazin-1-yl]acetic acid Traditional Name: 2-(1H-indol-3-yl)-2-[4-(3-methoxyphenyl)piperazino]acetic acid Formula: C21H23N3O3 MolecularWeight: 365.42562

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2CCN(CC2)C(C3=CNC4=CC=CC=C43)C(=O)O

Isomeric SMILES

COC1=CC=CC(=C1)N2CCN(CC2)C(C3=CNC4=CC=CC=C43)C(=O)O

InChI

InChI=1S/C21H23N3O3/c1-27-16-6-4-5-15(13-16)23-9-11-24(12-10-23)20(21(25)26)18-14-22-19-8-3-2-7-17(18)19/h2-8,13-14,20,22H,9-12H2,1H3,(H,25,26)