3-(5-chloranyl-3-methoxy-2-oxidanyl-phenyl)-2-(4-nitrophenyl)prop-2-enenitrile

Systemtic Name: 3-(5-chloranyl-3-methoxy-2-oxidanyl-phenyl)-2-(4-nitrophenyl)prop-2-enenitrile Openeye Name: 3-(5-chloro-2-hydroxy-3-methoxy-phenyl)-2-(4-nitrophenyl)prop-2-enenitrile CAS Name: 3-(5-chloro-2-hydroxy-3-methoxyphenyl)-2-(4-nitrophenyl)-2-propenenitrile IUPAC Name: 3-(5-chloro-2-hydroxy-3-methoxyphenyl)-2-(4-nitrophenyl)prop-2-enenitrile Traditional Name: 3-(5-chloro-2-hydroxy-3-methoxy-phenyl)-2-(4-nitrophenyl)acrylonitrile Formula: C16H11ClN2O4 MolecularWeight: 330.72254

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)Cl)C=C(C#N)C2=CC=C(C=C2)[N+](=O)[O-])O

Isomeric SMILES

COC1=C(C(=CC(=C1)Cl)C=C(C#N)C2=CC=C(C=C2)[N+](=O)[O-])O

InChI

InChI=1S/C16H11ClN2O4/c1-23-15-8-13(17)7-11(16(15)20)6-12(9-18)10-2-4-14(5-3-10)19(21)22/h2-8,20H,1H3