3-(4-methoxyphenyl)carbonyl-1,2-bis(propylsulfonyl)indolizine-6-carboxylic acid

Systemtic Name: 3-(4-methoxyphenyl)carbonyl-1,2-bis(propylsulfonyl)indolizine-6-carboxylic acid Openeye Name: 3-(4-methoxybenzoyl)-1,2-bis(propylsulfonyl)indolizine-6-carboxylic acid CAS Name: 3-[(4-methoxyphenyl)-oxomethyl]-1,2-bis(propylsulfonyl)-6-indolizinecarboxylic acid IUPAC Name: 3-(4-methoxybenzoyl)-1,2-bis(propylsulfonyl)indolizine-6-carboxylic acid Traditional Name: 3-p-anisoyl-1,2-bis(propylsulfonyl)indolizine-6-carboxylic acid Formula: C23H25NO8S2 MolecularWeight: 507.5765

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)C1=C2C=CC(=CN2C(=C1S(=O)(=O)CCC)C(=O)C3=CC=C(C=C3)OC)C(=O)O

Isomeric SMILES

CCCS(=O)(=O)C1=C2C=CC(=CN2C(=C1S(=O)(=O)CCC)C(=O)C3=CC=C(C=C3)OC)C(=O)O

InChI

InChI=1S/C23H25NO8S2/c1-4-12-33(28,29)21-18-11-8-16(23(26)27)14-24(18)19(22(21)34(30,31)13-5-2)20(25)15-6-9-17(32-3)10-7-15/h6-11,14H,4-5,12-13H2,1-3H3,(H,26,27)