[1-[hydroxymethyl-(2-oxidanyl-2-phenyl-ethyl)amino]-3-(1H-indol-3-yl)-2-methyl-1-oxidanylidene-propan-2-yl]oxysulfonylcarbamic acid

Systemtic Name: [1-[hydroxymethyl-(2-oxidanyl-2-phenyl-ethyl)amino]-3-(1H-indol-3-yl)-2-methyl-1-oxidanylidene-propan-2-yl]oxysulfonylcarbamic acid Openeye Name: [2-[hydroxymethyl-(2-hydroxy-2-phenyl-ethyl)amino]-1-(1H-indol-3-ylmethyl)-1-methyl-2-oxo-ethoxy]sulfonylcarbamic acid CAS Name: [1-[hydroxymethyl-(2-hydroxy-2-phenylethyl)amino]-3-(1H-indol-3-yl)-2-methyl-1-oxopropan-2-yl]oxysulfonylcarbamic acid IUPAC Name: [1-[hydroxymethyl-(2-hydroxy-2-phenylethyl)amino]-3-(1H-indol-3-yl)-2-methyl-1-oxopropan-2-yl]oxysulfonylcarbamic acid Traditional Name: [2-[(2-hydroxy-2-phenyl-ethyl)-methylol-amino]-1-(1H-indol-3-ylmethyl)-2-keto-1-methyl-ethoxy]sulfonylcarbamic acid Formula: C22H25N3O8S MolecularWeight: 491.5142

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CNC2=CC=CC=C21)(C(=O)N(CC(C3=CC=CC=C3)O)CO)OS(=O)(=O)NC(=O)O

Isomeric SMILES

CC(CC1=CNC2=CC=CC=C21)(C(=O)N(CC(C3=CC=CC=C3)O)CO)OS(=O)(=O)NC(=O)O

InChI

InChI=1S/C22H25N3O8S/c1-22(33-34(31,32)24-21(29)30,11-16-12-23-18-10-6-5-9-17(16)18)20(28)25(14-26)13-19(27)15-7-3-2-4-8-15/h2-10,12,19,23-24,26-27H,11,13-14H2,1H3,(H,29,30)