3',6'-Dibutoxyspiro(isobenzofuran-1(3H),9'-(9H)xanthene)-3-one

Details

Stereochemistry	ACHIRAL
Molecular Formula	C28H28O5
Molecular Weight	444.5189
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 3',6'-Dibutoxyspiro(isobenzofuran-1(3H),9'-(9H)xanthene)-3-one

Structure Search

SMILES

CCCCOC1=CC=C2C(OC3=CC(OCCCC)=CC=C3C24OC(=O)C5=CC=CC=C45)=C1

InChI

InChIKey=NISVSXJMPPNUMP-UHFFFAOYSA-N

InChI=1S/C28H28O5/c1-3-5-15-30-19-11-13-23-25(17-19)32-26-18-20(31-16-6-4-2)12-14-24(26)28(23)22-10-8-7-9-21(22)27(29)33-28/h7-14,17-18H,3-6,15-16H2,1-2H3

HIDE SMILES / InChI

Molecular Formula	C28H28O5
Molecular Weight	444.5189
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Tue Apr 01 19:31:47 GMT 2025` Edited by `admin` on `Tue Apr 01 19:31:47 GMT 2025`
Record UNII	3QTE5379ZN
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

3',6'-dibutoxyspiro[2-benzofuran-3,9'-xanthene]-1-one

Preferred Name

English

3',6'-Dibutoxyspiro(isobenzofuran-1(3H),9'-(9H)xanthene)-3-one

Systematic Name

English

3?,6?-Dibutoxyspiro[isobenzofuran-1(3H),9?-[9H]xanthen]-3-one

Systematic Name

English

Spiro[isobenzofuran-1(3H),9?-[9H]xanthen]-3-one, 3?,6?-dibutoxy-

Systematic Name

English

Code System Code Type Description

CAS

85391-01-1