Compound C24H28ClNO3

3-ethyl-7-methoxy-2-phenyl-8-(piperidin-1-ium-1-ylmethyl)chromen-4-one chloride

CAS: 67272-18-8

Molecular Formula	`C24H28ClNO3`
Molecular Weight	413.9 g/mol
Topological Polar Surface Area	40.0 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	4
Rotatable Bonds	5
Exact Mass	413.17578
Heavy Atoms	29
Complexity	574.0

Chemical Identifiers

CAS Number	67272-18-8
SMILES	`CCC1=C(OC2=C(C1=O)C=CC(=C2C[NH+]3CCCCC3)OC)C4=CC=CC=C4.[Cl-]`
InChIKey	`RTMDJQDYNKVXSP-UHFFFAOYSA-N`

📖 Product Overview

Compound C24H28ClNO3 (CAS: 67272-18-8) is a chemical compound with molecular formula C24H28ClNO3 and molecular weight 413.9 g/mol. Its IUPAC systematic name is 3-ethyl-7-methoxy-2-phenyl-8-(piperidin-1-ium-1-ylmethyl)chromen-4-one chloride. Topological Polar Surface Area 40.0 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 4 Rotatable Bonds 5 Exact Mass 413.17578 Heavy Atoms 29 Complexity 574.0 InChI Key: RTMDJQDYNKVXSP-UHFFFAOYSA-N. SMILES: CCC1=C(OC2=C(C1=O)C=CC(=C2C[NH+]3CCCCC3)OC)C4=CC=CC=C4.[Cl-].

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