octadecyl (E)-3-(3,5-ditert-butylcyclohexa-1,5-dien-1-yl)-2-oxidanyl-prop-2-enoate

Systemtic Name: octadecyl (E)-3-(3,5-ditert-butylcyclohexa-1,5-dien-1-yl)-2-oxidanyl-prop-2-enoate Openeye Name: octadecyl (E)-3-(3,5-ditert-butylcyclohexa-1,5-dien-1-yl)-2-hydroxy-prop-2-enoate CAS Name: (E)-3-(3,5-ditert-butyl-1-cyclohexa-1,5-dienyl)-2-hydroxy-2-propenoic acid octadecyl ester IUPAC Name: octadecyl (E)-3-(3,5-ditert-butylcyclohexa-1,5-dien-1-yl)-2-hydroxyprop-2-enoate Traditional Name: (E)-3-(3,5-ditert-butylcyclohexa-1,5-dien-1-yl)-2-hydroxy-acrylic acid stearyl ester Formula: C35H62O3 MolecularWeight: 530.86498

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC(=O)C(=CC1=CC(CC(=C1)C(C)(C)C)C(C)(C)C)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC(=O)/C(=C\C1=CC(CC(=C1)C(C)(C)C)C(C)(C)C)/O

InChI

InChI=1S/C35H62O3/c1-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-38-33(37)32(36)27-29-25-30(34(2,3)4)28-31(26-29)35(5,6)7/h25-27,30,36H,8-24,28H2,1-7H3/b32-27+