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

Systemtic Name: 1-methyl-5-(2-oxidanylidenespiro[1H-3,1-benzoxazine-4,1'-cyclohexane]-6-yl)pyrrole-2-carbonitrile Openeye Name: 1-methyl-5-(2-oxospiro[1H-3,1-benzoxazine-4,1'-cyclohexane]-6-yl)pyrrole-2-carbonitrile CAS Name: 1-methyl-5-(2-oxo-6-spiro[1H-3,1-benzoxazine-4,1'-cyclohexane]yl)-2-pyrrolecarbonitrile IUPAC Name: 1-methyl-5-(2-oxospiro[1H-3,1-benzoxazine-4,1'-cyclohexane]-6-yl)pyrrole-2-carbonitrile Traditional Name: 5-(2-ketospiro[1H-3,1-benzoxazine-4,1'-cyclohexane]-6-yl)-1-methyl-pyrrole-2-carbonitrile Formula: C19H19N3O2 MolecularWeight: 321.37306

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC=C1C2=CC3=C(C=C2)NC(=O)OC34CCCCC4)C#N

Isomeric SMILES

CN1C(=CC=C1C2=CC3=C(C=C2)NC(=O)OC34CCCCC4)C#N

InChI

InChI=1S/C19H19N3O2/c1-22-14(12-20)6-8-17(22)13-5-7-16-15(11-13)19(24-18(23)21-16)9-3-2-4-10-19/h5-8,11H,2-4,9-10H2,1H3,(H,21,23)