ethyl 4-[3-(1-ethylindol-3-yl)-3-(4-fluorophenyl)propanoyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[3-(1-ethylindol-3-yl)-3-(4-fluorophenyl)propanoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[3-(1-ethylindol-3-yl)-3-(4-fluorophenyl)propanoyl]piperazine-1-carboxylate CAS Name: 4-[3-(1-ethyl-3-indolyl)-3-(4-fluorophenyl)-1-oxopropyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[3-(1-ethylindol-3-yl)-3-(4-fluorophenyl)propanoyl]piperazine-1-carboxylate Traditional Name: 4-[3-(1-ethylindol-3-yl)-3-(4-fluorophenyl)propanoyl]piperazine-1-carboxylic acid ethyl ester Formula: C26H30FN3O3 MolecularWeight: 451.533103

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C2=CC=CC=C21)C(CC(=O)N3CCN(CC3)C(=O)OCC)C4=CC=C(C=C4)F

Isomeric SMILES

CCN1C=C(C2=CC=CC=C21)C(CC(=O)N3CCN(CC3)C(=O)OCC)C4=CC=C(C=C4)F

InChI

InChI=1S/C26H30FN3O3/c1-3-28-18-23(21-7-5-6-8-24(21)28)22(19-9-11-20(27)12-10-19)17-25(31)29-13-15-30(16-14-29)26(32)33-4-2/h5-12,18,22H,3-4,13-17H2,1-2H3