2-[cyclohexylmethyl-[2-(6-methoxy-1H-indol-3-yl)-2-oxidanylidene-ethanoyl]amino]-2-methyl-propanoic acid

Systemtic Name: 2-[cyclohexylmethyl-[2-(6-methoxy-1H-indol-3-yl)-2-oxidanylidene-ethanoyl]amino]-2-methyl-propanoic acid Openeye Name: 2-[cyclohexylmethyl-[2-(6-methoxy-1H-indol-3-yl)-2-oxo-acetyl]amino]-2-methyl-propanoic acid CAS Name: 2-[cyclohexylmethyl-[2-(6-methoxy-1H-indol-3-yl)-1,2-dioxoethyl]amino]-2-methylpropanoic acid IUPAC Name: 2-[cyclohexylmethyl-[2-(6-methoxy-1H-indol-3-yl)-2-oxoacetyl]amino]-2-methylpropanoic acid Traditional Name: 2-[cyclohexylmethyl-[2-keto-2-(6-methoxy-1H-indol-3-yl)acetyl]amino]-2-methyl-propionic acid Formula: C22H28N2O5 MolecularWeight: 400.46812

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)O)N(CC1CCCCC1)C(=O)C(=O)C2=CNC3=C2C=CC(=C3)OC

Isomeric SMILES

CC(C)(C(=O)O)N(CC1CCCCC1)C(=O)C(=O)C2=CNC3=C2C=CC(=C3)OC

InChI

InChI=1S/C22H28N2O5/c1-22(2,21(27)28)24(13-14-7-5-4-6-8-14)20(26)19(25)17-12-23-18-11-15(29-3)9-10-16(17)18/h9-12,14,23H,4-8,13H2,1-3H3,(H,27,28)