3-[(6-methanoyl-3-oxidanylidene-1,4-benzoxazin-4-yl)methyl]-5-methyl-benzenecarbonitrile

Systemtic Name: 3-[(6-methanoyl-3-oxidanylidene-1,4-benzoxazin-4-yl)methyl]-5-methyl-benzenecarbonitrile Openeye Name: 3-[(6-formyl-3-oxo-1,4-benzoxazin-4-yl)methyl]-5-methyl-benzonitrile CAS Name: 3-[(6-formyl-3-oxo-1,4-benzoxazin-4-yl)methyl]-5-methylbenzonitrile IUPAC Name: 3-[(6-formyl-3-oxo-1,4-benzoxazin-4-yl)methyl]-5-methylbenzonitrile Traditional Name: 3-[(6-formyl-3-keto-1,4-benzoxazin-4-yl)methyl]-5-methyl-benzonitrile Formula: C18H14N2O3 MolecularWeight: 306.31536

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C#N)CN2C(=O)COC3=C2C=C(C=C3)C=O

Isomeric SMILES

CC1=CC(=CC(=C1)C#N)CN2C(=O)COC3=C2C=C(C=C3)C=O

InChI

InChI=1S/C18H14N2O3/c1-12-4-14(8-19)6-15(5-12)9-20-16-7-13(10-21)2-3-17(16)23-11-18(20)22/h2-7,10H,9,11H2,1H3