2-[3-(1-naphthalen-1-ylsulfonylpiperidin-4-yl)-2-oxidanylidene-imidazo[4,5-b]pyridin-1-yl]ethanoic acid

Systemtic Name: 2-[3-(1-naphthalen-1-ylsulfonylpiperidin-4-yl)-2-oxidanylidene-imidazo[4,5-b]pyridin-1-yl]ethanoic acid Openeye Name: 2-[3-[1-(1-naphthylsulfonyl)-4-piperidyl]-2-oxo-imidazo[4,5-b]pyridin-1-yl]acetic acid CAS Name: 2-[3-[1-(1-naphthalenylsulfonyl)-4-piperidinyl]-2-oxo-1-imidazo[4,5-b]pyridinyl]acetic acid IUPAC Name: 2-[3-(1-naphthalen-1-ylsulfonylpiperidin-4-yl)-2-oxoimidazo[4,5-b]pyridin-1-yl]acetic acid Traditional Name: 2-[2-keto-3-[1-(1-naphthylsulfonyl)-4-piperidyl]imidazo[4,5-b]pyridin-1-yl]acetic acid Formula: C23H22N4O5S MolecularWeight: 466.50958

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N2C3=C(C=CC=N3)N(C2=O)CC(=O)O)S(=O)(=O)C4=CC=CC5=CC=CC=C54

Isomeric SMILES

C1CN(CCC1N2C3=C(C=CC=N3)N(C2=O)CC(=O)O)S(=O)(=O)C4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C23H22N4O5S/c28-21(29)15-26-19-8-4-12-24-22(19)27(23(26)30)17-10-13-25(14-11-17)33(31,32)20-9-3-6-16-5-1-2-7-18(16)20/h1-9,12,17H,10-11,13-15H2,(H,28,29)