(Z)-2-(5-chloranyl-1,3-benzoxazol-2-yl)-3-[(5-nitro-2-oxidanyl-phenyl)amino]prop-2-enenitrile

Systemtic Name: (Z)-2-(5-chloranyl-1,3-benzoxazol-2-yl)-3-[(5-nitro-2-oxidanyl-phenyl)amino]prop-2-enenitrile Openeye Name: (Z)-2-(5-chloro-1,3-benzoxazol-2-yl)-3-(2-hydroxy-5-nitro-anilino)prop-2-enenitrile CAS Name: (Z)-2-(5-chloro-1,3-benzoxazol-2-yl)-3-(2-hydroxy-5-nitroanilino)-2-propenenitrile IUPAC Name: (Z)-2-(5-chloro-1,3-benzoxazol-2-yl)-3-(2-hydroxy-5-nitroanilino)prop-2-enenitrile Traditional Name: (Z)-2-(5-chloro-1,3-benzoxazol-2-yl)-3-(2-hydroxy-5-nitro-anilino)acrylonitrile Formula: C16H9ClN4O4 MolecularWeight: 356.72006

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1[N+](=O)[O-])NC=C(C#N)C2=NC3=C(O2)C=CC(=C3)Cl)O

Isomeric SMILES

C1=CC(=C(C=C1[N+](=O)[O-])N/C=C(/C#N)\C2=NC3=C(O2)C=CC(=C3)Cl)O

InChI

InChI=1S/C16H9ClN4O4/c17-10-1-4-15-13(5-10)20-16(25-15)9(7-18)8-19-12-6-11(21(23)24)2-3-14(12)22/h1-6,8,19,22H/b9-8-