3-(4-tert-butylphenyl)sulfonyl-6-nitro-chromen-2-one

Systemtic Name: 3-(4-tert-butylphenyl)sulfonyl-6-nitro-chromen-2-one Openeye Name: 3-(4-tert-butylphenyl)sulfonyl-6-nitro-chromen-2-one CAS Name: 3-(4-tert-butylphenyl)sulfonyl-6-nitro-1-benzopyran-2-one IUPAC Name: 3-(4-tert-butylphenyl)sulfonyl-6-nitrochromen-2-one Traditional Name: 3-(4-tert-butylphenyl)sulfonyl-6-nitro-coumarin Formula: C19H17NO6S MolecularWeight: 387.40638

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)C2=CC3=C(C=CC(=C3)[N+](=O)[O-])OC2=O

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)C2=CC3=C(C=CC(=C3)[N+](=O)[O-])OC2=O

InChI

InChI=1S/C19H17NO6S/c1-19(2,3)13-4-7-15(8-5-13)27(24,25)17-11-12-10-14(20(22)23)6-9-16(12)26-18(17)21/h4-11H,1-3H3