3-cyano-3-phenyl-2,4-dihydro-1,4-benzoxazine-6-carboxylic acid

Systemtic Name: 3-cyano-3-phenyl-2,4-dihydro-1,4-benzoxazine-6-carboxylic acid Openeye Name: 3-cyano-3-phenyl-2,4-dihydro-1,4-benzoxazine-6-carboxylic acid CAS Name: 3-cyano-3-phenyl-2,4-dihydro-1,4-benzoxazine-6-carboxylic acid IUPAC Name: 3-cyano-3-phenyl-2,4-dihydro-1,4-benzoxazine-6-carboxylic acid Traditional Name: 3-cyano-3-phenyl-2,4-dihydro-1,4-benzoxazine-6-carboxylic acid Formula: C16H12N2O3 MolecularWeight: 280.27808

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Descriptors Computed from Structure

Canonical SMILES:

C1C(NC2=C(O1)C=CC(=C2)C(=O)O)(C#N)C3=CC=CC=C3

Isomeric SMILES

C1C(NC2=C(O1)C=CC(=C2)C(=O)O)(C#N)C3=CC=CC=C3

InChI

InChI=1S/C16H12N2O3/c17-9-16(12-4-2-1-3-5-12)10-21-14-7-6-11(15(19)20)8-13(14)18-16/h1-8,18H,10H2,(H,19,20)