phenyl 7-methoxy-3-(phenylmethyl)imidazo[1,2-a]pyridine-5-sulfonate

Systemtic Name: phenyl 7-methoxy-3-(phenylmethyl)imidazo[1,2-a]pyridine-5-sulfonate Openeye Name: phenyl 3-benzyl-7-methoxy-imidazo[1,2-a]pyridine-5-sulfonate CAS Name: 7-methoxy-3-(phenylmethyl)-5-imidazo[1,2-a]pyridinesulfonic acid phenyl ester IUPAC Name: phenyl 3-benzyl-7-methoxyimidazo[1,2-a]pyridine-5-sulfonate Traditional Name: 3-benzyl-7-methoxy-imidazo[1,2-a]pyridine-5-sulfonic acid phenyl ester Formula: C21H18N2O4S MolecularWeight: 394.44362

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=NC=C(N2C(=C1)S(=O)(=O)OC3=CC=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

COC1=CC2=NC=C(N2C(=C1)S(=O)(=O)OC3=CC=CC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C21H18N2O4S/c1-26-19-13-20-22-15-17(12-16-8-4-2-5-9-16)23(20)21(14-19)28(24,25)27-18-10-6-3-7-11-18/h2-11,13-15H,12H2,1H3