3-[2-[(2-chloranyl-4-fluoranyl-phenyl)methylamino]-2-oxidanylidene-ethyl]-1H-indole-2-carboxylic acid

Systemtic Name: 3-[2-[(2-chloranyl-4-fluoranyl-phenyl)methylamino]-2-oxidanylidene-ethyl]-1H-indole-2-carboxylic acid Openeye Name: 3-[2-[(2-chloro-4-fluoro-phenyl)methylamino]-2-oxo-ethyl]-1H-indole-2-carboxylic acid CAS Name: 3-[2-[(2-chloro-4-fluorophenyl)methylamino]-2-oxoethyl]-1H-indole-2-carboxylic acid IUPAC Name: 3-[2-[(2-chloro-4-fluorophenyl)methylamino]-2-oxoethyl]-1H-indole-2-carboxylic acid Traditional Name: 3-[2-[(2-chloro-4-fluoro-benzyl)amino]-2-keto-ethyl]-1H-indole-2-carboxylic acid Formula: C18H14ClFN2O3 MolecularWeight: 360.766763

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C(N2)C(=O)O)CC(=O)NCC3=C(C=C(C=C3)F)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=C(N2)C(=O)O)CC(=O)NCC3=C(C=C(C=C3)F)Cl

InChI

InChI=1S/C18H14ClFN2O3/c19-14-7-11(20)6-5-10(14)9-21-16(23)8-13-12-3-1-2-4-15(12)22-17(13)18(24)25/h1-7,22H,8-9H2,(H,21,23)(H,24,25)