2-(3,5-ditert-butyl-4-oxidanyl-phenyl)-2-[[4-(2-diethylaminoethyloxy)phenyl]methylamino]ethanoic acid

Systemtic Name: 2-(3,5-ditert-butyl-4-oxidanyl-phenyl)-2-[[4-(2-diethylaminoethyloxy)phenyl]methylamino]ethanoic acid Openeye Name: 2-(3,5-ditert-butyl-4-hydroxy-phenyl)-2-[[4-(2-diethylaminoethyloxy)phenyl]methylamino]acetic acid CAS Name: 2-(3,5-ditert-butyl-4-hydroxyphenyl)-2-[[4-(2-diethylaminoethyloxy)phenyl]methylamino]acetic acid IUPAC Name: 2-(3,5-ditert-butyl-4-hydroxyphenyl)-2-[[4-(2-diethylaminoethyloxy)phenyl]methylamino]acetic acid Traditional Name: 2-(3,5-ditert-butyl-4-hydroxy-phenyl)-2-[[4-(2-diethylaminoethyloxy)benzyl]amino]acetic acid Formula: C29H44N2O4 MolecularWeight: 484.67066

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCOC1=CC=C(C=C1)CNC(C2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C)C(=O)O

Isomeric SMILES

CCN(CC)CCOC1=CC=C(C=C1)CNC(C2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C)C(=O)O

InChI

InChI=1S/C29H44N2O4/c1-9-31(10-2)15-16-35-22-13-11-20(12-14-22)19-30-25(27(33)34)21-17-23(28(3,4)5)26(32)24(18-21)29(6,7)8/h11-14,17-18,25,30,32H,9-10,15-16,19H2,1-8H3,(H,33,34)