7-[(4-tert-butylphenyl)methoxy]-4-methyl-6-nitro-chromen-2-one

Systemtic Name: 7-[(4-tert-butylphenyl)methoxy]-4-methyl-6-nitro-chromen-2-one Openeye Name: 7-[(4-tert-butylphenyl)methoxy]-4-methyl-6-nitro-chromen-2-one CAS Name: 7-[(4-tert-butylphenyl)methoxy]-4-methyl-6-nitro-1-benzopyran-2-one IUPAC Name: 7-[(4-tert-butylphenyl)methoxy]-4-methyl-6-nitrochromen-2-one Traditional Name: 7-(4-tert-butylbenzyl)oxy-4-methyl-6-nitro-coumarin Formula: C21H21NO5 MolecularWeight: 367.39514

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=CC(=C(C=C12)[N+](=O)[O-])OCC3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CC1=CC(=O)OC2=CC(=C(C=C12)[N+](=O)[O-])OCC3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C21H21NO5/c1-13-9-20(23)27-18-11-19(17(22(24)25)10-16(13)18)26-12-14-5-7-15(8-6-14)21(2,3)4/h5-11H,12H2,1-4H3