[(9R)-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-9-yl] 4-chloranylbenzoate

Systemtic Name: [(9R)-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-9-yl] 4-chloranylbenzoate Openeye Name: [(9R)-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-9-yl] 4-chlorobenzoate CAS Name: 4-chlorobenzoic acid [(9R)-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-9-yl] ester IUPAC Name: [(9R)-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-9-yl] 4-chlorobenzoate Traditional Name: 4-chlorobenzoic acid [(9R)-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-9-yl] ester Formula: C17H16ClNO2 MolecularWeight: 301.76744

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C(C1)OC(=O)C3=CC=C(C=C3)Cl)N=CC=C2

Isomeric SMILES

C1CCC2=C([C@@H](C1)OC(=O)C3=CC=C(C=C3)Cl)N=CC=C2

InChI

InChI=1S/C17H16ClNO2/c18-14-9-7-13(8-10-14)17(20)21-15-6-2-1-4-12-5-3-11-19-16(12)15/h3,5,7-11,15H,1-2,4,6H2/t15-/m1/s1