carbonic acid; 4-(phenylmethyl)benzene-1,3-dicarbonitrile

Systemtic Name: carbonic acid; 4-(phenylmethyl)benzene-1,3-dicarbonitrile Openeye Name: 4-benzylbenzene-1,3-dicarbonitrile; carbonic acid CAS Name: carbonic acid; 4-(phenylmethyl)benzene-1,3-dicarbonitrile IUPAC Name: 4-benzylbenzene-1,3-dicarbonitrile; carbonic acid Traditional Name: 4-benzylisophthalonitrile; carbonic acid Formula: C16H12N2O3 MolecularWeight: 280.27808

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=C(C=C(C=C2)C#N)C#N.C(=O)(O)O

Isomeric SMILES

C1=CC=C(C=C1)CC2=C(C=C(C=C2)C#N)C#N.C(=O)(O)O

InChI

InChI=1S/C15H10N2.CH2O3/c16-10-13-6-7-14(15(9-13)11-17)8-12-4-2-1-3-5-12;2-1(3)4/h1-7,9H,8H2;(H2,2,3,4)