4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butylcarbamoyl butanoate

Systemtic Name: 4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butylcarbamoyl butanoate Openeye Name: 4-[2,4-bis(1,1-dimethylpropyl)phenoxy]butylcarbamoyl butanoate CAS Name: butanoic acid [[4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butylamino]-oxomethyl] ester IUPAC Name: 4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butylcarbamoyl butanoate Traditional Name: butyric acid 4-(2,4-ditert-amylphenoxy)butylcarbamoyl ester Formula: C25H41NO4 MolecularWeight: 419.59734

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OC(=O)NCCCCOC1=C(C=C(C=C1)C(C)(C)CC)C(C)(C)CC

Isomeric SMILES

CCCC(=O)OC(=O)NCCCCOC1=C(C=C(C=C1)C(C)(C)CC)C(C)(C)CC

InChI

InChI=1S/C25H41NO4/c1-8-13-22(27)30-23(28)26-16-11-12-17-29-21-15-14-19(24(4,5)9-2)18-20(21)25(6,7)10-3/h14-15,18H,8-13,16-17H2,1-7H3,(H,26,28)