1-[2-[(3-chloranyl-2,6-diethyl-phenyl)amino]-2-oxidanylidene-ethyl]cycloheptane-1-carboxylate

Systemtic Name: 1-[2-[(3-chloranyl-2,6-diethyl-phenyl)amino]-2-oxidanylidene-ethyl]cycloheptane-1-carboxylate Openeye Name: 1-[2-(3-chloro-2,6-diethyl-anilino)-2-oxo-ethyl]cycloheptanecarboxylate CAS Name: 1-[2-(3-chloro-2,6-diethylanilino)-2-oxoethyl]-1-cycloheptanecarboxylate IUPAC Name: 1-[2-(3-chloro-2,6-diethylanilino)-2-oxoethyl]cycloheptane-1-carboxylate Traditional Name: 1-[2-(3-chloro-2,6-diethyl-anilino)-2-keto-ethyl]cycloheptanecarboxylate Formula: C20H27ClNO3- MolecularWeight: 364.88628

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(C=C1)Cl)CC)NC(=O)CC2(CCCCCC2)C(=O)[O-]

Isomeric SMILES

CCC1=C(C(=C(C=C1)Cl)CC)NC(=O)CC2(CCCCCC2)C(=O)[O-]

InChI

InChI=1S/C20H28ClNO3/c1-3-14-9-10-16(21)15(4-2)18(14)22-17(23)13-20(19(24)25)11-7-5-6-8-12-20/h9-10H,3-8,11-13H2,1-2H3,(H,22,23)(H,24,25)/p-1