[3-(4-chloranylbutyl)-1-piperazin-1-ylcarbonyl-indol-5-yl] hydrogen carbonate

Systemtic Name: [3-(4-chloranylbutyl)-1-piperazin-1-ylcarbonyl-indol-5-yl] hydrogen carbonate Openeye Name: [3-(4-chlorobutyl)-1-(piperazine-1-carbonyl)indol-5-yl] hydrogen carbonate CAS Name: carbonic acid [3-(4-chlorobutyl)-1-[oxo(1-piperazinyl)methyl]-5-indolyl] ester IUPAC Name: [3-(4-chlorobutyl)-1-(piperazine-1-carbonyl)indol-5-yl] hydrogen carbonate Traditional Name: carbonic acid [3-(4-chlorobutyl)-1-(piperazine-1-carbonyl)indol-5-yl] ester Formula: C18H22ClN3O4 MolecularWeight: 379.83798

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C(=O)N2C=C(C3=C2C=CC(=C3)OC(=O)O)CCCCCl

Isomeric SMILES

C1CN(CCN1)C(=O)N2C=C(C3=C2C=CC(=C3)OC(=O)O)CCCCCl

InChI

InChI=1S/C18H22ClN3O4/c19-6-2-1-3-13-12-22(17(23)21-9-7-20-8-10-21)16-5-4-14(11-15(13)16)26-18(24)25/h4-5,11-12,20H,1-3,6-10H2,(H,24,25)