4-[butyl-[(E)-3-(3,5-ditert-butyl-4-oxidanyl-phenyl)prop-2-enoyl]amino]benzoic acid

Systemtic Name: 4-[butyl-[(E)-3-(3,5-ditert-butyl-4-oxidanyl-phenyl)prop-2-enoyl]amino]benzoic acid Openeye Name: 4-[butyl-[(E)-3-(3,5-ditert-butyl-4-hydroxy-phenyl)prop-2-enoyl]amino]benzoic acid CAS Name: 4-[butyl-[(E)-3-(3,5-ditert-butyl-4-hydroxyphenyl)-1-oxoprop-2-enyl]amino]benzoic acid IUPAC Name: 4-[butyl-[(E)-3-(3,5-ditert-butyl-4-hydroxyphenyl)prop-2-enoyl]amino]benzoic acid Traditional Name: 4-[butyl-[(E)-3-(3,5-ditert-butyl-4-hydroxy-phenyl)acryloyl]amino]benzoic acid Formula: C28H37NO4 MolecularWeight: 451.59768

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C1=CC=C(C=C1)C(=O)O)C(=O)C=CC2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C

Isomeric SMILES

CCCCN(C1=CC=C(C=C1)C(=O)O)C(=O)/C=C/C2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C

InChI

InChI=1S/C28H37NO4/c1-8-9-16-29(21-13-11-20(12-14-21)26(32)33)24(30)15-10-19-17-22(27(2,3)4)25(31)23(18-19)28(5,6)7/h10-15,17-18,31H,8-9,16H2,1-7H3,(H,32,33)/b15-10+