Bicyclo[4.1.0]heptane-7-carboxylic acid, (3-oxo-1(3H)-isobenzofuranylidene)di-4,1-phenylene ester

CAS Registry Number®

497820-23-2
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CAS Name

Bicyclo[4.1.0]heptane-7-carboxylic acid, (3-oxo-1(3H)-isobenzofuranylidene)di-4,1-phenylene ester

Molecular Formula

C36H34O6

Molecular Mass

562.65

Cite this Page

Bicyclo[4.1.0]heptane-7-carboxylic acid, (3-oxo-1(3H)-isobenzofuranylidene)di-4,1-phenylene ester.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=497820-23-2 (retrieved 2024-08-14) (CAS RN: 497820-23-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C36H34O6/c37-33-29-11-5-6-12-30(29)36(42-33,21-13-17-23(18-14-21)40-34(38)31-25-7-1-2-8-26(25)31)22-15-19-24(20-16-22)41-35(39)32-27-9-3-4-10-28(27)32/h5-6,11-20,25-28,31-32H,1-4,7-10H2

InChIKey

InChIKey=SMLZOAVHWOGOAJ-UHFFFAOYSA-N

SMILES

O=C1OC(C=2C1=CC=CC2)(C3=CC=C(OC(=O)C4C5C4CCCC5)C=C3)C6=CC=C(OC(=O)C7C8C7CCCC8)C=C6

Canonical SMILES

O=C1OC(C2=CC=C(OC(=O)C3C4CCCCC34)C=C2)(C5=CC=C(OC(=O)C6C7CCCCC67)C=C5)C=8C=CC=CC18

Other Names for this Substance

  • Bicyclo[4.1.0]heptane-7-carboxylic acid, (3-oxo-1(3H)-isobenzofuranylidene)di-4,1-phenylene ester