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

Systemtic Name: ethyl 3-[2-[4-(2,3-dimethylphenyl)piperazin-1-yl]ethanoylamino]-5-ethoxy-1H-indole-2-carboxylate Openeye Name: ethyl 3-[[2-[4-(2,3-dimethylphenyl)piperazin-1-yl]acetyl]amino]-5-ethoxy-1H-indole-2-carboxylate CAS Name: 3-[[2-[4-(2,3-dimethylphenyl)-1-piperazinyl]-1-oxoethyl]amino]-5-ethoxy-1H-indole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 3-[[2-[4-(2,3-dimethylphenyl)piperazin-1-yl]acetyl]amino]-5-ethoxy-1H-indole-2-carboxylate Traditional Name: 3-[[2-[4-(2,3-dimethylphenyl)piperazino]acetyl]amino]-5-ethoxy-1H-indole-2-carboxylic acid ethyl ester Formula: C27H34N4O4 MolecularWeight: 478.58326

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)NC(=C2NC(=O)CN3CCN(CC3)C4=CC=CC(=C4C)C)C(=O)OCC

Isomeric SMILES

CCOC1=CC2=C(C=C1)NC(=C2NC(=O)CN3CCN(CC3)C4=CC=CC(=C4C)C)C(=O)OCC

InChI

InChI=1S/C27H34N4O4/c1-5-34-20-10-11-22-21(16-20)25(26(28-22)27(33)35-6-2)29-24(32)17-30-12-14-31(15-13-30)23-9-7-8-18(3)19(23)4/h7-11,16,28H,5-6,12-15,17H2,1-4H3,(H,29,32)