2-[[3-(1H-indol-3-yl)-1-methoxy-1-oxidanylidene-propan-2-yl]carbamoyl]benzoic acid

Systemtic Name: 2-[[3-(1H-indol-3-yl)-1-methoxy-1-oxidanylidene-propan-2-yl]carbamoyl]benzoic acid Openeye Name: 2-[[1-(1H-indol-3-ylmethyl)-2-methoxy-2-oxo-ethyl]carbamoyl]benzoic acid CAS Name: 2-[[[3-(1H-indol-3-yl)-1-methoxy-1-oxopropan-2-yl]amino]-oxomethyl]benzoic acid IUPAC Name: 2-[[3-(1H-indol-3-yl)-1-methoxy-1-oxopropan-2-yl]carbamoyl]benzoic acid Traditional Name: 2-[[1-(1H-indol-3-ylmethyl)-2-keto-2-methoxy-ethyl]carbamoyl]benzoic acid Formula: C20H18N2O5 MolecularWeight: 366.36732

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CNC2=CC=CC=C21)NC(=O)C3=CC=CC=C3C(=O)O

Isomeric SMILES

COC(=O)C(CC1=CNC2=CC=CC=C21)NC(=O)C3=CC=CC=C3C(=O)O

InChI

InChI=1S/C20H18N2O5/c1-27-20(26)17(10-12-11-21-16-9-5-4-6-13(12)16)22-18(23)14-7-2-3-8-15(14)19(24)25/h2-9,11,17,21H,10H2,1H3,(H,22,23)(H,24,25)