4-[2-[(4-fluorophenyl)methylamino]ethanoyl]-2-oxidanylidene-1-(3-phenylpropyl)-3H-quinoxaline-6-carboxylic acid

Systemtic Name: 4-[2-[(4-fluorophenyl)methylamino]ethanoyl]-2-oxidanylidene-1-(3-phenylpropyl)-3H-quinoxaline-6-carboxylic acid Openeye Name: 4-[2-[(4-fluorophenyl)methylamino]acetyl]-2-oxo-1-(3-phenylpropyl)-3H-quinoxaline-6-carboxylic acid CAS Name: 4-[2-[(4-fluorophenyl)methylamino]-1-oxoethyl]-2-oxo-1-(3-phenylpropyl)-3H-quinoxaline-6-carboxylic acid IUPAC Name: 4-[2-[(4-fluorophenyl)methylamino]acetyl]-2-oxo-1-(3-phenylpropyl)-3H-quinoxaline-6-carboxylic acid Traditional Name: 4-[2-[(4-fluorobenzyl)amino]acetyl]-2-keto-1-(3-phenylpropyl)-3H-quinoxaline-6-carboxylic acid Formula: C27H26FN3O4 MolecularWeight: 475.511443

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)N(C2=C(N1C(=O)CNCC3=CC=C(C=C3)F)C=C(C=C2)C(=O)O)CCCC4=CC=CC=C4

Isomeric SMILES

C1C(=O)N(C2=C(N1C(=O)CNCC3=CC=C(C=C3)F)C=C(C=C2)C(=O)O)CCCC4=CC=CC=C4

InChI

InChI=1S/C27H26FN3O4/c28-22-11-8-20(9-12-22)16-29-17-25(32)31-18-26(33)30(14-4-7-19-5-2-1-3-6-19)23-13-10-21(27(34)35)15-24(23)31/h1-3,5-6,8-13,15,29H,4,7,14,16-18H2,(H,34,35)