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

Systemtic Name: 7-[4-(azepan-1-ylcarbonyl)piperidin-1-yl]sulfonyl-2-methyl-1,2,3,4-tetrahydroacridine-9-carboxylic acid Openeye Name: 7-[[4-(azepane-1-carbonyl)-1-piperidyl]sulfonyl]-2-methyl-1,2,3,4-tetrahydroacridine-9-carboxylic acid CAS Name: 7-[[4-[1-azepanyl(oxo)methyl]-1-piperidinyl]sulfonyl]-2-methyl-1,2,3,4-tetrahydroacridine-9-carboxylic acid IUPAC Name: 7-[4-(azepane-1-carbonyl)piperidin-1-yl]sulfonyl-2-methyl-1,2,3,4-tetrahydroacridine-9-carboxylic acid Traditional Name: 7-[4-(azepane-1-carbonyl)piperidino]sulfonyl-2-methyl-1,2,3,4-tetrahydroacridine-9-carboxylic acid Formula: C27H35N3O5S MolecularWeight: 513.6489

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)C(=C3C=C(C=CC3=N2)S(=O)(=O)N4CCC(CC4)C(=O)N5CCCCCC5)C(=O)O

Isomeric SMILES

CC1CCC2=C(C1)C(=C3C=C(C=CC3=N2)S(=O)(=O)N4CCC(CC4)C(=O)N5CCCCCC5)C(=O)O

InChI

InChI=1S/C27H35N3O5S/c1-18-6-8-23-21(16-18)25(27(32)33)22-17-20(7-9-24(22)28-23)36(34,35)30-14-10-19(11-15-30)26(31)29-12-4-2-3-5-13-29/h7,9,17-19H,2-6,8,10-16H2,1H3,(H,32,33)