ethyl 5-ethoxy-3-[2-(4-phenylpiperazin-1-yl)ethanoylamino]-1H-indole-2-carboxylate

Systemtic Name: ethyl 5-ethoxy-3-[2-(4-phenylpiperazin-1-yl)ethanoylamino]-1H-indole-2-carboxylate Openeye Name: ethyl 5-ethoxy-3-[[2-(4-phenylpiperazin-1-yl)acetyl]amino]-1H-indole-2-carboxylate CAS Name: 5-ethoxy-3-[[1-oxo-2-(4-phenyl-1-piperazinyl)ethyl]amino]-1H-indole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 5-ethoxy-3-[[2-(4-phenylpiperazin-1-yl)acetyl]amino]-1H-indole-2-carboxylate Traditional Name: 5-ethoxy-3-[[2-(4-phenylpiperazino)acetyl]amino]-1H-indole-2-carboxylic acid ethyl ester Formula: C25H30N4O4 MolecularWeight: 450.5301

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)NC(=C2NC(=O)CN3CCN(CC3)C4=CC=CC=C4)C(=O)OCC

Isomeric SMILES

CCOC1=CC2=C(C=C1)NC(=C2NC(=O)CN3CCN(CC3)C4=CC=CC=C4)C(=O)OCC

InChI

InChI=1S/C25H30N4O4/c1-3-32-19-10-11-21-20(16-19)23(24(26-21)25(31)33-4-2)27-22(30)17-28-12-14-29(15-13-28)18-8-6-5-7-9-18/h5-11,16,26H,3-4,12-15,17H2,1-2H3,(H,27,30)