2-[2-[3,4-bis(oxidanyl)phenyl]carbonyl-3-oxidanyl-phenyl]prop-2-enenitrile

Systemtic Name: 2-[2-[3,4-bis(oxidanyl)phenyl]carbonyl-3-oxidanyl-phenyl]prop-2-enenitrile Openeye Name: 2-[2-(3,4-dihydroxybenzoyl)-3-hydroxy-phenyl]prop-2-enenitrile CAS Name: 2-[2-[(3,4-dihydroxyphenyl)-oxomethyl]-3-hydroxyphenyl]-2-propenenitrile IUPAC Name: 2-[2-(3,4-dihydroxybenzoyl)-3-hydroxyphenyl]prop-2-enenitrile Traditional Name: 2-(3-hydroxy-2-protocatechuoyl-phenyl)acrylonitrile Formula: C16H11NO4 MolecularWeight: 281.26284

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Descriptors Computed from Structure

Canonical SMILES:

C=C(C#N)C1=C(C(=CC=C1)O)C(=O)C2=CC(=C(C=C2)O)O

Isomeric SMILES

C=C(C#N)C1=C(C(=CC=C1)O)C(=O)C2=CC(=C(C=C2)O)O

InChI

InChI=1S/C16H11NO4/c1-9(8-17)11-3-2-4-13(19)15(11)16(21)10-5-6-12(18)14(20)7-10/h2-7,18-20H,1H2