1-phenylcycloheptane-1-carboxylate

Systemtic Name: 1-phenylcycloheptane-1-carboxylate Openeye Name: 1-phenylcycloheptanecarboxylate CAS Name: 1-phenyl-1-cycloheptanecarboxylate IUPAC Name: 1-phenylcycloheptane-1-carboxylate Traditional Name: 1-phenylcycloheptanecarboxylate Formula: C14H17O2- MolecularWeight: 217.28358

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)(C2=CC=CC=C2)C(=O)[O-]

Isomeric SMILES

C1CCCC(CC1)(C2=CC=CC=C2)C(=O)[O-]

InChI

InChI=1S/C14H18O2/c15-13(16)14(10-6-1-2-7-11-14)12-8-4-3-5-9-12/h3-5,8-9H,1-2,6-7,10-11H2,(H,15,16)/p-1