potassium 2-butyl-5-(3-chlorophenyl)carbonyl-5,6,7,8-tetrahydroindolizine-8-carboxylate

Systemtic Name: potassium 2-butyl-5-(3-chlorophenyl)carbonyl-5,6,7,8-tetrahydroindolizine-8-carboxylate Openeye Name: potassium 2-butyl-5-(3-chlorobenzoyl)-5,6,7,8-tetrahydroindolizine-8-carboxylate CAS Name: potassium 2-butyl-5-[(3-chlorophenyl)-oxomethyl]-5,6,7,8-tetrahydroindolizine-8-carboxylate IUPAC Name: potassium 2-butyl-5-(3-chlorobenzoyl)-5,6,7,8-tetrahydroindolizine-8-carboxylate Traditional Name: potassium 2-butyl-5-(3-chlorobenzoyl)-5,6,7,8-tetrahydroindolizine-8-carboxylate Formula: C20H21ClKNO3 MolecularWeight: 397.93694

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CN2C(CCC(C2=C1)C(=O)[O-])C(=O)C3=CC(=CC=C3)Cl.[K+]

Isomeric SMILES

CCCCC1=CN2C(CCC(C2=C1)C(=O)[O-])C(=O)C3=CC(=CC=C3)Cl.[K+]

InChI

InChI=1S/C20H22ClNO3.K/c1-2-3-5-13-10-18-16(20(24)25)8-9-17(22(18)12-13)19(23)14-6-4-7-15(21)11-14;/h4,6-7,10-12,16-17H,2-3,5,8-9H2,1H3,(H,24,25);/q;+1/p-1