3-[[3,5-bis(chloranyl)-4-[(3-propan-2-yl-1H-indol-5-yl)oxy]phenyl]amino]-3-oxidanylidene-propanoic acid

Systemtic Name: 3-[[3,5-bis(chloranyl)-4-[(3-propan-2-yl-1H-indol-5-yl)oxy]phenyl]amino]-3-oxidanylidene-propanoic acid Openeye Name: 3-[3,5-dichloro-4-[(3-isopropyl-1H-indol-5-yl)oxy]anilino]-3-oxo-propanoic acid CAS Name: 3-[3,5-dichloro-4-[(3-propan-2-yl-1H-indol-5-yl)oxy]anilino]-3-oxopropanoic acid IUPAC Name: 3-[3,5-dichloro-4-[(3-propan-2-yl-1H-indol-5-yl)oxy]anilino]-3-oxopropanoic acid Traditional Name: 3-[3,5-dichloro-4-[(3-isopropyl-1H-indol-5-yl)oxy]anilino]-3-keto-propionic acid Formula: C20H18Cl2N2O4 MolecularWeight: 421.27392

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CNC2=C1C=C(C=C2)OC3=C(C=C(C=C3Cl)NC(=O)CC(=O)O)Cl

Isomeric SMILES

CC(C)C1=CNC2=C1C=C(C=C2)OC3=C(C=C(C=C3Cl)NC(=O)CC(=O)O)Cl

InChI

InChI=1S/C20H18Cl2N2O4/c1-10(2)14-9-23-17-4-3-12(7-13(14)17)28-20-15(21)5-11(6-16(20)22)24-18(25)8-19(26)27/h3-7,9-10,23H,8H2,1-2H3,(H,24,25)(H,26,27)