[[1-(oxolan-2-yl)-2-(quinolin-3-ylmethylsulfonyl)ethyl]amino] benzoate

Systemtic Name: [[1-(oxolan-2-yl)-2-(quinolin-3-ylmethylsulfonyl)ethyl]amino] benzoate Openeye Name: [[2-(3-quinolylmethylsulfonyl)-1-tetrahydrofuran-2-yl-ethyl]amino] benzoate CAS Name: benzoic acid [[1-(2-oxolanyl)-2-(3-quinolinylmethylsulfonyl)ethyl]amino] ester IUPAC Name: [[1-(oxolan-2-yl)-2-(quinolin-3-ylmethylsulfonyl)ethyl]amino] benzoate Traditional Name: benzoic acid [[2-(3-quinolylmethylsulfonyl)-1-(tetrahydrofuryl)ethyl]amino] ester Formula: C23H24N2O5S MolecularWeight: 440.51206

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)C(CS(=O)(=O)CC2=CC3=CC=CC=C3N=C2)NOC(=O)C4=CC=CC=C4

Isomeric SMILES

C1CC(OC1)C(CS(=O)(=O)CC2=CC3=CC=CC=C3N=C2)NOC(=O)C4=CC=CC=C4

InChI

InChI=1S/C23H24N2O5S/c26-23(18-7-2-1-3-8-18)30-25-21(22-11-6-12-29-22)16-31(27,28)15-17-13-19-9-4-5-10-20(19)24-14-17/h1-5,7-10,13-14,21-22,25H,6,11-12,15-16H2