tert-butyl 4-[(1-ethoxycarbonylcyclohexyl)methylcarbamoyl]benzoate

Systemtic Name: tert-butyl 4-[(1-ethoxycarbonylcyclohexyl)methylcarbamoyl]benzoate Openeye Name: tert-butyl 4-[(1-ethoxycarbonylcyclohexyl)methylcarbamoyl]benzoate CAS Name: 4-[[(1-ethoxycarbonylcyclohexyl)methylamino]-oxomethyl]benzoic acid tert-butyl ester IUPAC Name: tert-butyl 4-[(1-ethoxycarbonylcyclohexyl)methylcarbamoyl]benzoate Traditional Name: 4-[(1-carbethoxycyclohexyl)methylcarbamoyl]benzoic acid tert-butyl ester Formula: C22H31NO5 MolecularWeight: 389.48524

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCCCC1)CNC(=O)C2=CC=C(C=C2)C(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)C1(CCCCC1)CNC(=O)C2=CC=C(C=C2)C(=O)OC(C)(C)C

InChI

InChI=1S/C22H31NO5/c1-5-27-20(26)22(13-7-6-8-14-22)15-23-18(24)16-9-11-17(12-10-16)19(25)28-21(2,3)4/h9-12H,5-8,13-15H2,1-4H3,(H,23,24)