[3-(3-azanyl-4-chloranyl-phenoxy)-3-oxidanylidene-propyl] 3,5-ditert-butyl-4-oxidanyl-benzoate

Systemtic Name: [3-(3-azanyl-4-chloranyl-phenoxy)-3-oxidanylidene-propyl] 3,5-ditert-butyl-4-oxidanyl-benzoate Openeye Name: [3-(3-amino-4-chloro-phenoxy)-3-oxo-propyl] 3,5-ditert-butyl-4-hydroxy-benzoate CAS Name: 3,5-ditert-butyl-4-hydroxybenzoic acid [3-(3-amino-4-chlorophenoxy)-3-oxopropyl] ester IUPAC Name: [3-(3-amino-4-chlorophenoxy)-3-oxopropyl] 3,5-ditert-butyl-4-hydroxybenzoate Traditional Name: 3,5-ditert-butyl-4-hydroxy-benzoic acid [3-(3-amino-4-chloro-phenoxy)-3-keto-propyl] ester Formula: C24H30ClNO5 MolecularWeight: 447.9517

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C(=O)OCCC(=O)OC2=CC(=C(C=C2)Cl)N

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C(=O)OCCC(=O)OC2=CC(=C(C=C2)Cl)N

InChI

InChI=1S/C24H30ClNO5/c1-23(2,3)16-11-14(12-17(21(16)28)24(4,5)6)22(29)30-10-9-20(27)31-15-7-8-18(25)19(26)13-15/h7-8,11-13,28H,9-10,26H2,1-6H3