[6-[3-(4-chlorophenyl)-3-oxidanylidene-propanoyl]cyclohex-3-en-1-yl] hydrogen carbonate

Systemtic Name: [6-[3-(4-chlorophenyl)-3-oxidanylidene-propanoyl]cyclohex-3-en-1-yl] hydrogen carbonate Openeye Name: [6-[3-(4-chlorophenyl)-3-oxo-propanoyl]cyclohex-3-en-1-yl] hydrogen carbonate CAS Name: carbonic acid [6-[3-(4-chlorophenyl)-1,3-dioxopropyl]-1-cyclohex-3-enyl] ester IUPAC Name: [6-[3-(4-chlorophenyl)-3-oxopropanoyl]cyclohex-3-en-1-yl] hydrogen carbonate Traditional Name: carbonic acid [6-[3-(4-chlorophenyl)-3-keto-propanoyl]cyclohex-3-en-1-yl] ester Formula: C16H15ClO5 MolecularWeight: 322.7403

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CCC(C1C(=O)CC(=O)C2=CC=C(C=C2)Cl)OC(=O)O

Isomeric SMILES

C1C=CCC(C1C(=O)CC(=O)C2=CC=C(C=C2)Cl)OC(=O)O

InChI

InChI=1S/C16H15ClO5/c17-11-7-5-10(6-8-11)13(18)9-14(19)12-3-1-2-4-15(12)22-16(20)21/h1-2,5-8,12,15H,3-4,9H2,(H,20,21)