Carbanilic acid, o-(propoxymethyl)-, 2-(1-pyrrolidinyl)ethyl ester, oxalate (1:1)

HCID 54556

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Basic information

CAS: 80293-72-7
Standard SMILES: CC.CCCOCc1ccccc1NC(=O)OCC.C[NH+]1CCCC1.O=C([O-])C(=O)O
InChIKey: ABNARGQPNORECO-UHFFFAOYSA-N
Molecular formula: C22H38N2O7
Average molar mass: 442.5 g/mol
Monoisotopic mass: 442.26790156

Names & identifiers

Preferred name: Carbanilic acid, o-(propoxymethyl)-, 2-(1-pyrrolidinyl)ethyl ester, oxalate (1:1)
IUPAC: ethane;ethyl N-[2-(propoxymethyl)phenyl]carbamate;2-hydroxy-2-oxoacetate;1-methylpyrrolidin-1-ium
English name: CARBANILIC ACID, o-(PROPOXYMETHYL)-, 2-(1-PYRROLIDINYL)ETHYL ESTER, OX ALATE (1:1
Molecular formula: C19H28N2O7
Molecular weight: 396.44

Names & synonyms

AMK 233Carbanilic acid, o-(propoxymethyl)-, 2-(1-pyrrolidinyl)ethyl ester, oxalate (1:1)80293-72-7DTXSID90230213o-(Propoxymethyl)carbanilic acid 2-(1-pyrrolidinyl)ethyl ester oxalate (1:1)RefChem:333124DTXCID90152704CARBANILIC ACID, o-(PROPOXYMETHYL)-, 2-(1-PYRROLIDINYL)ETHYL ESTER, OX ALATE (1:1

Database identifiers

CAS: 80293-72-7
PubChem CID: 54556
DTXSID: DTXSID90230213

Properties

Computed structural properties

Topological polar surface area: 129 Å²
Hydrogen bond donors: 3
Hydrogen bond acceptors: 7
Rotatable bonds: 7
Heavy atoms: 31
Formal charge: 0
Complexity: 336

Chemistry & industry

Suppliers1 total

HONEST JOY HOLDINGS LIMITED[email protected]

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