[2-[(4-methylcyclohexyl)amino]-2-oxidanylidene-ethyl] 3-chloranyl-5-methoxy-4-propan-2-yloxy-benzoate

Systemtic Name: [2-[(4-methylcyclohexyl)amino]-2-oxidanylidene-ethyl] 3-chloranyl-5-methoxy-4-propan-2-yloxy-benzoate Openeye Name: [2-[(4-methylcyclohexyl)amino]-2-oxo-ethyl] 3-chloro-4-isopropoxy-5-methoxy-benzoate CAS Name: 3-chloro-5-methoxy-4-propan-2-yloxybenzoic acid [2-[(4-methylcyclohexyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(4-methylcyclohexyl)amino]-2-oxoethyl] 3-chloro-5-methoxy-4-propan-2-yloxybenzoate Traditional Name: 3-chloro-4-isopropoxy-5-methoxy-benzoic acid [2-keto-2-[(4-methylcyclohexyl)amino]ethyl] ester Formula: C20H28ClNO5 MolecularWeight: 397.89302

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)NC(=O)COC(=O)C2=CC(=C(C(=C2)Cl)OC(C)C)OC

Isomeric SMILES

CC1CCC(CC1)NC(=O)COC(=O)C2=CC(=C(C(=C2)Cl)OC(C)C)OC

InChI

InChI=1S/C20H28ClNO5/c1-12(2)27-19-16(21)9-14(10-17(19)25-4)20(24)26-11-18(23)22-15-7-5-13(3)6-8-15/h9-10,12-13,15H,5-8,11H2,1-4H3,(H,22,23)