(E)-3-(4-tert-butylphenyl)-N-(3-oxidanylidene-4H-1,4-benzoxazin-7-yl)prop-2-enamide

Systemtic Name: (E)-3-(4-tert-butylphenyl)-N-(3-oxidanylidene-4H-1,4-benzoxazin-7-yl)prop-2-enamide Openeye Name: (E)-3-(4-tert-butylphenyl)-N-(3-oxo-4H-1,4-benzoxazin-7-yl)prop-2-enamide CAS Name: (E)-3-(4-tert-butylphenyl)-N-(3-oxo-4H-1,4-benzoxazin-7-yl)-2-propenamide IUPAC Name: (E)-3-(4-tert-butylphenyl)-N-(3-oxo-4H-1,4-benzoxazin-7-yl)prop-2-enamide Traditional Name: (E)-3-(4-tert-butylphenyl)-N-(3-keto-4H-1,4-benzoxazin-7-yl)acrylamide Formula: C21H22N2O3 MolecularWeight: 350.41098

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C=CC(=O)NC2=CC3=C(C=C2)NC(=O)CO3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)/C=C/C(=O)NC2=CC3=C(C=C2)NC(=O)CO3

InChI

InChI=1S/C21H22N2O3/c1-21(2,3)15-7-4-14(5-8-15)6-11-19(24)22-16-9-10-17-18(12-16)26-13-20(25)23-17/h4-12H,13H2,1-3H3,(H,22,24)(H,23,25)/b11-6+