4-[2-(4-tert-butylphenyl)ethyl]-3-oxidanylidene-1,4-benzoxazine-6-carbaldehyde

Systemtic Name: 4-[2-(4-tert-butylphenyl)ethyl]-3-oxidanylidene-1,4-benzoxazine-6-carbaldehyde Openeye Name: 4-[2-(4-tert-butylphenyl)ethyl]-3-oxo-1,4-benzoxazine-6-carbaldehyde CAS Name: 4-[2-(4-tert-butylphenyl)ethyl]-3-oxo-1,4-benzoxazine-6-carboxaldehyde IUPAC Name: 4-[2-(4-tert-butylphenyl)ethyl]-3-oxo-1,4-benzoxazine-6-carbaldehyde Traditional Name: 4-[2-(4-tert-butylphenyl)ethyl]-3-keto-1,4-benzoxazine-6-carbaldehyde Formula: C21H23NO3 MolecularWeight: 337.41222

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CCN2C(=O)COC3=C2C=C(C=C3)C=O

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CCN2C(=O)COC3=C2C=C(C=C3)C=O

InChI

InChI=1S/C21H23NO3/c1-21(2,3)17-7-4-15(5-8-17)10-11-22-18-12-16(13-23)6-9-19(18)25-14-20(22)24/h4-9,12-13H,10-11,14H2,1-3H3