7-[4-[(phenylmethyl)carbamoyl]piperidin-1-yl]sulfonyl-1,2,3,4-tetrahydroacridine-9-carboxylic acid

Systemtic Name: 7-[4-[(phenylmethyl)carbamoyl]piperidin-1-yl]sulfonyl-1,2,3,4-tetrahydroacridine-9-carboxylic acid Openeye Name: 7-[[4-(benzylcarbamoyl)-1-piperidyl]sulfonyl]-1,2,3,4-tetrahydroacridine-9-carboxylic acid CAS Name: 7-[[4-[oxo-[(phenylmethyl)amino]methyl]-1-piperidinyl]sulfonyl]-1,2,3,4-tetrahydroacridine-9-carboxylic acid IUPAC Name: 7-[4-(benzylcarbamoyl)piperidin-1-yl]sulfonyl-1,2,3,4-tetrahydroacridine-9-carboxylic acid Traditional Name: 7-[4-(benzylcarbamoyl)piperidino]sulfonyl-1,2,3,4-tetrahydroacridine-9-carboxylic acid Formula: C27H29N3O5S MolecularWeight: 507.60126

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=C3C=C(C=CC3=N2)S(=O)(=O)N4CCC(CC4)C(=O)NCC5=CC=CC=C5)C(=O)O

Isomeric SMILES

C1CCC2=C(C1)C(=C3C=C(C=CC3=N2)S(=O)(=O)N4CCC(CC4)C(=O)NCC5=CC=CC=C5)C(=O)O

InChI

InChI=1S/C27H29N3O5S/c31-26(28-17-18-6-2-1-3-7-18)19-12-14-30(15-13-19)36(34,35)20-10-11-24-22(16-20)25(27(32)33)21-8-4-5-9-23(21)29-24/h1-3,6-7,10-11,16,19H,4-5,8-9,12-15,17H2,(H,28,31)(H,32,33)