(2S)-N-(3-chloranyl-4-cyano-phenyl)-4-ethanoyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide

Systemtic Name: (2S)-N-(3-chloranyl-4-cyano-phenyl)-4-ethanoyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Openeye Name: (2S)-4-acetyl-N-(3-chloro-4-cyano-phenyl)-2,3-dihydro-1,4-benzoxazine-2-carboxamide CAS Name: (2S)-4-acetyl-N-(3-chloro-4-cyanophenyl)-2,3-dihydro-1,4-benzoxazine-2-carboxamide IUPAC Name: (2S)-4-acetyl-N-(3-chloro-4-cyanophenyl)-2,3-dihydro-1,4-benzoxazine-2-carboxamide Traditional Name: (2S)-4-acetyl-N-(3-chloro-4-cyano-phenyl)-2,3-dihydro-1,4-benzoxazine-2-carboxamide Formula: C18H14ClN3O3 MolecularWeight: 355.77506

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CC(OC2=CC=CC=C21)C(=O)NC3=CC(=C(C=C3)C#N)Cl

Isomeric SMILES

CC(=O)N1C[C@H](OC2=CC=CC=C21)C(=O)NC3=CC(=C(C=C3)C#N)Cl

InChI

InChI=1S/C18H14ClN3O3/c1-11(23)22-10-17(25-16-5-3-2-4-15(16)22)18(24)21-13-7-6-12(9-20)14(19)8-13/h2-8,17H,10H2,1H3,(H,21,24)/t17-/m0/s1