ethyl 3-[2-(4-ethylpiperazin-1-yl)ethanoylamino]-1,5-dimethyl-indole-2-carboxylate

Systemtic Name: ethyl 3-[2-(4-ethylpiperazin-1-yl)ethanoylamino]-1,5-dimethyl-indole-2-carboxylate Openeye Name: ethyl 3-[[2-(4-ethylpiperazin-1-yl)acetyl]amino]-1,5-dimethyl-indole-2-carboxylate CAS Name: 3-[[2-(4-ethyl-1-piperazinyl)-1-oxoethyl]amino]-1,5-dimethyl-2-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[[2-(4-ethylpiperazin-1-yl)acetyl]amino]-1,5-dimethylindole-2-carboxylate Traditional Name: 3-[[2-(4-ethylpiperazino)acetyl]amino]-1,5-dimethyl-indole-2-carboxylic acid ethyl ester Formula: C21H30N4O3 MolecularWeight: 386.4879

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)CC(=O)NC2=C(N(C3=C2C=C(C=C3)C)C)C(=O)OCC

Isomeric SMILES

CCN1CCN(CC1)CC(=O)NC2=C(N(C3=C2C=C(C=C3)C)C)C(=O)OCC

InChI

InChI=1S/C21H30N4O3/c1-5-24-9-11-25(12-10-24)14-18(26)22-19-16-13-15(3)7-8-17(16)23(4)20(19)21(27)28-6-2/h7-8,13H,5-6,9-12,14H2,1-4H3,(H,22,26)