3-[2-[[3-(diethylamino)-2-oxidanyl-propyl]carbamoyl]-1-phenyl-indol-3-yl]oxy-2-methyl-3-oxidanylidene-propanoic acid

Systemtic Name: 3-[2-[[3-(diethylamino)-2-oxidanyl-propyl]carbamoyl]-1-phenyl-indol-3-yl]oxy-2-methyl-3-oxidanylidene-propanoic acid Openeye Name: 3-[2-[[3-(diethylamino)-2-hydroxy-propyl]carbamoyl]-1-phenyl-indol-3-yl]oxy-2-methyl-3-oxo-propanoic acid CAS Name: 3-[[2-[[[3-(diethylamino)-2-hydroxypropyl]amino]-oxomethyl]-1-phenyl-3-indolyl]oxy]-2-methyl-3-oxopropanoic acid IUPAC Name: 3-[2-[[3-(diethylamino)-2-hydroxypropyl]carbamoyl]-1-phenylindol-3-yl]oxy-2-methyl-3-oxopropanoic acid Traditional Name: 3-[2-[[3-(diethylamino)-2-hydroxy-propyl]carbamoyl]-1-phenyl-indol-3-yl]oxy-3-keto-2-methyl-propionic acid Formula: C26H31N3O6 MolecularWeight: 481.54084

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC(CNC(=O)C1=C(C2=CC=CC=C2N1C3=CC=CC=C3)OC(=O)C(C)C(=O)O)O

Isomeric SMILES

CCN(CC)CC(CNC(=O)C1=C(C2=CC=CC=C2N1C3=CC=CC=C3)OC(=O)C(C)C(=O)O)O

InChI

InChI=1S/C26H31N3O6/c1-4-28(5-2)16-19(30)15-27-24(31)22-23(35-26(34)17(3)25(32)33)20-13-9-10-14-21(20)29(22)18-11-7-6-8-12-18/h6-14,17,19,30H,4-5,15-16H2,1-3H3,(H,27,31)(H,32,33)