1-methyl-5-(2-oxidanylidenespiro[1H-3,1-benzoxazine-4,1'-cyclobutane]-6-yl)pyrrole-2-carbonitrile

Systemtic Name: 1-methyl-5-(2-oxidanylidenespiro[1H-3,1-benzoxazine-4,1'-cyclobutane]-6-yl)pyrrole-2-carbonitrile Openeye Name: 1-methyl-5-(2-oxospiro[1H-3,1-benzoxazine-4,1'-cyclobutane]-6-yl)pyrrole-2-carbonitrile CAS Name: 1-methyl-5-(2-oxo-6-spiro[1H-3,1-benzoxazine-4,1'-cyclobutane]yl)-2-pyrrolecarbonitrile IUPAC Name: 1-methyl-5-(2-oxospiro[1H-3,1-benzoxazine-4,1'-cyclobutane]-6-yl)pyrrole-2-carbonitrile Traditional Name: 5-(2-ketospiro[1H-3,1-benzoxazine-4,1'-cyclobutane]-6-yl)-1-methyl-pyrrole-2-carbonitrile Formula: C17H15N3O2 MolecularWeight: 293.3199

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC=C1C2=CC3=C(C=C2)NC(=O)OC34CCC4)C#N

Isomeric SMILES

CN1C(=CC=C1C2=CC3=C(C=C2)NC(=O)OC34CCC4)C#N

InChI

InChI=1S/C17H15N3O2/c1-20-12(10-18)4-6-15(20)11-3-5-14-13(9-11)17(7-2-8-17)22-16(21)19-14/h3-6,9H,2,7-8H2,1H3,(H,19,21)