5-Methyl-7-(2-methylphenyl)-1,2,3,7-tetrahydroindolizine-6,8-dicarboxylic acid diethyl ester

HCID 12377943

Notes Reactions

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Basic information

Standard SMILES: CCOC(=O)C1=C(C)N2CCCC2=C(C(=O)OCC)C1c1ccccc1C
InChIKey: RHOGMOAAXSYSQH-UHFFFAOYSA-N
Molecular formula: C22H27NO4
Average molar mass: 369.5 g/mol
Monoisotopic mass: 369.19400834

Names & identifiers

Preferred name: 5-Methyl-7-(2-methylphenyl)-1,2,3,7-tetrahydroindolizine-6,8-dicarboxylic acid diethyl ester
IUPAC: diethyl 5-methyl-7-(2-methylphenyl)-1,2,3,7-tetrahydroindolizine-6,8-dicarboxylate

Names & synonyms

SCHEMBL11725765RHOGMOAAXSYSQH-UHFFFAOYSA-N5-methyl-7-(2-methylphenyl)-1,2,3,7-tetrahydroindolizine-6,8-dicarboxylic acid diethyl ester

Database identifiers

PubChem CID: 12377943

Properties

Computed structural properties

XLogP: 3.8
Topological polar surface area: 55.8 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 5
Rotatable bonds: 7
Heavy atoms: 27
Formal charge: 0
Complexity: 663

Related reactions

7 records

New reaction record

HRID 972881As productuspto-grants-1977_10

HRID 1415313As productuspto-grants-1977_01

HRID 1580996As productuspto-grants-1976_01

HRID 1604996As productuspto-grants-1976_04

HRID 1605980As productuspto-grants-1976_04

HRID 1606009As productuspto-grants-1976_04

HRID 2398287As productuspto-grants-1977_05

Compound notes

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