2-[butyl-[(E)-3-(3,5-ditert-butyl-4-oxidanyl-phenyl)prop-2-enoyl]amino]ethyl pyridine-4-carboxylate

Systemtic Name: 2-[butyl-[(E)-3-(3,5-ditert-butyl-4-oxidanyl-phenyl)prop-2-enoyl]amino]ethyl pyridine-4-carboxylate Openeye Name: 2-[butyl-[(E)-3-(3,5-ditert-butyl-4-hydroxy-phenyl)prop-2-enoyl]amino]ethyl pyridine-4-carboxylate CAS Name: 4-pyridinecarboxylic acid 2-[butyl-[(E)-3-(3,5-ditert-butyl-4-hydroxyphenyl)-1-oxoprop-2-enyl]amino]ethyl ester IUPAC Name: 2-[butyl-[(E)-3-(3,5-ditert-butyl-4-hydroxyphenyl)prop-2-enoyl]amino]ethyl pyridine-4-carboxylate Traditional Name: isonicotinic acid 2-[butyl-[(E)-3-(3,5-ditert-butyl-4-hydroxy-phenyl)acryloyl]amino]ethyl ester Formula: C29H40N2O4 MolecularWeight: 480.6389

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H40N2O4/c1-8-9-16-31(17-18-35-27(34)22-12-14-30-15-13-22)25(32)11-10-21-19-23(28(2,3)4)26(33)24(20-21)29(5,6)7/h10-15,19-20,33H,8-9,16-18H2,1-7H3/b11-10+