N-butylsulfonyl-7-[(2,4-dichlorophenyl)methyl]-1-methyl-indolizin-4-ium-4-carboxamide

Systemtic Name: N-butylsulfonyl-7-[(2,4-dichlorophenyl)methyl]-1-methyl-indolizin-4-ium-4-carboxamide Openeye Name: N-butylsulfonyl-7-[(2,4-dichlorophenyl)methyl]-1-methyl-indolizin-4-ium-4-carboxamide CAS Name: N-butylsulfonyl-7-[(2,4-dichlorophenyl)methyl]-1-methyl-4-indolizin-4-iumcarboxamide IUPAC Name: N-butylsulfonyl-7-[(2,4-dichlorophenyl)methyl]-1-methylindolizin-4-ium-4-carboxamide Traditional Name: N-butylsulfonyl-7-(2,4-dichlorobenzyl)-1-methyl-indolizin-4-ium-4-carboxamide Formula: C21H23Cl2N2O3S+ MolecularWeight: 454.38992

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)NC(=O)[N+]12C=CC(=C1C=C(C=C2)CC3=C(C=C(C=C3)Cl)Cl)C

Isomeric SMILES

CCCCS(=O)(=O)NC(=O)[N+]12C=CC(=C1C=C(C=C2)CC3=C(C=C(C=C3)Cl)Cl)C

InChI

InChI=1S/C21H22Cl2N2O3S/c1-3-4-11-29(27,28)24-21(26)25-9-7-15(2)20(25)13-16(8-10-25)12-17-5-6-18(22)14-19(17)23/h5-10,13-14H,3-4,11-12H2,1-2H3/p+1