N-[2-[(4-acetamidophenyl)amino]-2-oxidanylidene-ethyl]-2-chloranyl-N-ethyl-quinoline-4-carboxamide

Systemtic Name: N-[2-[(4-acetamidophenyl)amino]-2-oxidanylidene-ethyl]-2-chloranyl-N-ethyl-quinoline-4-carboxamide Openeye Name: N-[2-(4-acetamidoanilino)-2-oxo-ethyl]-2-chloro-N-ethyl-quinoline-4-carboxamide CAS Name: N-[2-(4-acetamidoanilino)-2-oxoethyl]-2-chloro-N-ethyl-4-quinolinecarboxamide IUPAC Name: N-[2-(4-acetamidoanilino)-2-oxoethyl]-2-chloro-N-ethylquinoline-4-carboxamide Traditional Name: N-[2-(4-acetamidoanilino)-2-keto-ethyl]-2-chloro-N-ethyl-cinchoninamide Formula: C22H21ClN4O3 MolecularWeight: 424.88014

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(=O)NC1=CC=C(C=C1)NC(=O)C)C(=O)C2=CC(=NC3=CC=CC=C32)Cl

Isomeric SMILES

CCN(CC(=O)NC1=CC=C(C=C1)NC(=O)C)C(=O)C2=CC(=NC3=CC=CC=C32)Cl

InChI

InChI=1S/C22H21ClN4O3/c1-3-27(13-21(29)25-16-10-8-15(9-11-16)24-14(2)28)22(30)18-12-20(23)26-19-7-5-4-6-17(18)19/h4-12H,3,13H2,1-2H3,(H,24,28)(H,25,29)