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

Systemtic Name: ethyl 5-ethoxy-3-[2-[4-(phenylmethyl)piperazin-1-yl]ethanoylamino]-1H-indole-2-carboxylate Openeye Name: ethyl 3-[[2-(4-benzylpiperazin-1-yl)acetyl]amino]-5-ethoxy-1H-indole-2-carboxylate CAS Name: 5-ethoxy-3-[[1-oxo-2-[4-(phenylmethyl)-1-piperazinyl]ethyl]amino]-1H-indole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 3-[[2-(4-benzylpiperazin-1-yl)acetyl]amino]-5-ethoxy-1H-indole-2-carboxylate Traditional Name: 3-[[2-(4-benzylpiperazino)acetyl]amino]-5-ethoxy-1H-indole-2-carboxylic acid ethyl ester Formula: C26H32N4O4 MolecularWeight: 464.55668

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)NC(=C2NC(=O)CN3CCN(CC3)CC4=CC=CC=C4)C(=O)OCC

Isomeric SMILES

CCOC1=CC2=C(C=C1)NC(=C2NC(=O)CN3CCN(CC3)CC4=CC=CC=C4)C(=O)OCC

InChI

InChI=1S/C26H32N4O4/c1-3-33-20-10-11-22-21(16-20)24(25(27-22)26(32)34-4-2)28-23(31)18-30-14-12-29(13-15-30)17-19-8-6-5-7-9-19/h5-11,16,27H,3-4,12-15,17-18H2,1-2H3,(H,28,31)