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

Systemtic Name: 4-methyl-5-(2-oxidanylidenespiro[1H-3,1-benzoxazine-4,1'-cyclohexane]-6-yl)thiophene-2-carbonitrile Openeye Name: 4-methyl-5-(2-oxospiro[1H-3,1-benzoxazine-4,1'-cyclohexane]-6-yl)thiophene-2-carbonitrile CAS Name: 4-methyl-5-(2-oxo-6-spiro[1H-3,1-benzoxazine-4,1'-cyclohexane]yl)-2-thiophenecarbonitrile IUPAC Name: 4-methyl-5-(2-oxospiro[1H-3,1-benzoxazine-4,1'-cyclohexane]-6-yl)thiophene-2-carbonitrile Traditional Name: 5-(2-ketospiro[1H-3,1-benzoxazine-4,1'-cyclohexane]-6-yl)-4-methyl-thiophene-2-carbonitrile Formula: C19H18N2O2S MolecularWeight: 338.42342

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1)C#N)C2=CC3=C(C=C2)NC(=O)OC34CCCCC4

Isomeric SMILES

CC1=C(SC(=C1)C#N)C2=CC3=C(C=C2)NC(=O)OC34CCCCC4

InChI

InChI=1S/C19H18N2O2S/c1-12-9-14(11-20)24-17(12)13-5-6-16-15(10-13)19(23-18(22)21-16)7-3-2-4-8-19/h5-6,9-10H,2-4,7-8H2,1H3,(H,21,22)