2-(4-ethoxycarbonylpiperazin-1-yl)-2-(5-methyl-1H-indol-3-yl)ethanoic acid

Systemtic Name: 2-(4-ethoxycarbonylpiperazin-1-yl)-2-(5-methyl-1H-indol-3-yl)ethanoic acid Openeye Name: 2-(4-ethoxycarbonylpiperazin-1-yl)-2-(5-methyl-1H-indol-3-yl)acetic acid CAS Name: 2-(4-ethoxycarbonyl-1-piperazinyl)-2-(5-methyl-1H-indol-3-yl)acetic acid IUPAC Name: 2-(4-ethoxycarbonylpiperazin-1-yl)-2-(5-methyl-1H-indol-3-yl)acetic acid Traditional Name: 2-(4-carbethoxypiperazino)-2-(5-methyl-1H-indol-3-yl)acetic acid Formula: C18H23N3O4 MolecularWeight: 345.39292

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(C2=CNC3=C2C=C(C=C3)C)C(=O)O

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(C2=CNC3=C2C=C(C=C3)C)C(=O)O

InChI

InChI=1S/C18H23N3O4/c1-3-25-18(24)21-8-6-20(7-9-21)16(17(22)23)14-11-19-15-5-4-12(2)10-13(14)15/h4-5,10-11,16,19H,3,6-9H2,1-2H3,(H,22,23)