ethyl 1-[(E)-3-(3,5-ditert-butyl-4-oxidanyl-phenyl)prop-2-enoyl]piperidine-2-carboxylate

Systemtic Name: ethyl 1-[(E)-3-(3,5-ditert-butyl-4-oxidanyl-phenyl)prop-2-enoyl]piperidine-2-carboxylate Openeye Name: ethyl 1-[(E)-3-(3,5-ditert-butyl-4-hydroxy-phenyl)prop-2-enoyl]piperidine-2-carboxylate CAS Name: 1-[(E)-3-(3,5-ditert-butyl-4-hydroxyphenyl)-1-oxoprop-2-enyl]-2-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(E)-3-(3,5-ditert-butyl-4-hydroxyphenyl)prop-2-enoyl]piperidine-2-carboxylate Traditional Name: 1-[(E)-3-(3,5-ditert-butyl-4-hydroxy-phenyl)acryloyl]pipecolinic acid ethyl ester Formula: C25H37NO4 MolecularWeight: 415.56558

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCCN1C(=O)C=CC2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C

Isomeric SMILES

CCOC(=O)C1CCCCN1C(=O)/C=C/C2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C

InChI

InChI=1S/C25H37NO4/c1-8-30-23(29)20-11-9-10-14-26(20)21(27)13-12-17-15-18(24(2,3)4)22(28)19(16-17)25(5,6)7/h12-13,15-16,20,28H,8-11,14H2,1-7H3/b13-12+