(2E)-2-[6-(aminomethyl)-2,2-dimethyl-3H-1,3-benzoxazin-4-ylidene]-1-cycloheptyl-ethanone

Systemtic Name: (2E)-2-[6-(aminomethyl)-2,2-dimethyl-3H-1,3-benzoxazin-4-ylidene]-1-cycloheptyl-ethanone Openeye Name: (2E)-2-[6-(aminomethyl)-2,2-dimethyl-3H-1,3-benzoxazin-4-ylidene]-1-cycloheptyl-ethanone CAS Name: (2E)-2-[6-(aminomethyl)-2,2-dimethyl-3H-1,3-benzoxazin-4-ylidene]-1-cycloheptylethanone IUPAC Name: (2E)-2-[6-(aminomethyl)-2,2-dimethyl-3H-1,3-benzoxazin-4-ylidene]-1-cycloheptylethanone Traditional Name: (2E)-2-[6-(aminomethyl)-2,2-dimethyl-3H-1,3-benzoxazin-4-ylidene]-1-cycloheptyl-ethanone Formula: C20H28N2O2 MolecularWeight: 328.44852

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Descriptors Computed from Structure

Canonical SMILES:

CC1(NC(=CC(=O)C2CCCCCC2)C3=C(O1)C=CC(=C3)CN)C

Isomeric SMILES

CC1(N/C(=C/C(=O)C2CCCCCC2)/C3=C(O1)C=CC(=C3)CN)C

InChI

InChI=1S/C20H28N2O2/c1-20(2)22-17(12-18(23)15-7-5-3-4-6-8-15)16-11-14(13-21)9-10-19(16)24-20/h9-12,15,22H,3-8,13,21H2,1-2H3/b17-12+