7-[4-(butan-2-ylcarbamoyl)piperidin-1-yl]sulfonyl-2-methyl-1,2,3,4-tetrahydroacridine-9-carboxylic acid

Systemtic Name: 7-[4-(butan-2-ylcarbamoyl)piperidin-1-yl]sulfonyl-2-methyl-1,2,3,4-tetrahydroacridine-9-carboxylic acid Openeye Name: 2-methyl-7-[[4-(sec-butylcarbamoyl)-1-piperidyl]sulfonyl]-1,2,3,4-tetrahydroacridine-9-carboxylic acid CAS Name: 7-[[4-[(butan-2-ylamino)-oxomethyl]-1-piperidinyl]sulfonyl]-2-methyl-1,2,3,4-tetrahydroacridine-9-carboxylic acid IUPAC Name: 7-[4-(butan-2-ylcarbamoyl)piperidin-1-yl]sulfonyl-2-methyl-1,2,3,4-tetrahydroacridine-9-carboxylic acid Traditional Name: 2-methyl-7-[4-(sec-butylcarbamoyl)piperidino]sulfonyl-1,2,3,4-tetrahydroacridine-9-carboxylic acid Formula: C25H33N3O5S MolecularWeight: 487.61162

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1CCN(CC1)S(=O)(=O)C2=CC3=C(C4=C(CCC(C4)C)N=C3C=C2)C(=O)O

Isomeric SMILES

CCC(C)NC(=O)C1CCN(CC1)S(=O)(=O)C2=CC3=C(C4=C(CCC(C4)C)N=C3C=C2)C(=O)O

InChI

InChI=1S/C25H33N3O5S/c1-4-16(3)26-24(29)17-9-11-28(12-10-17)34(32,33)18-6-8-22-20(14-18)23(25(30)31)19-13-15(2)5-7-21(19)27-22/h6,8,14-17H,4-5,7,9-13H2,1-3H3,(H,26,29)(H,30,31)