2-(4-tert-butylphenyl)-6,7-dimethyl-3-[(4-nitrophenyl)methoxy]chromen-4-one

Systemtic Name: 2-(4-tert-butylphenyl)-6,7-dimethyl-3-[(4-nitrophenyl)methoxy]chromen-4-one Openeye Name: 2-(4-tert-butylphenyl)-6,7-dimethyl-3-[(4-nitrophenyl)methoxy]chromen-4-one CAS Name: 2-(4-tert-butylphenyl)-6,7-dimethyl-3-[(4-nitrophenyl)methoxy]-1-benzopyran-4-one IUPAC Name: 2-(4-tert-butylphenyl)-6,7-dimethyl-3-[(4-nitrophenyl)methoxy]chromen-4-one Traditional Name: 2-(4-tert-butylphenyl)-6,7-dimethyl-3-(4-nitrobenzyl)oxy-chromone Formula: C28H27NO5 MolecularWeight: 457.51768

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=O)C(=C(O2)C3=CC=C(C=C3)C(C)(C)C)OCC4=CC=C(C=C4)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=O)C(=C(O2)C3=CC=C(C=C3)C(C)(C)C)OCC4=CC=C(C=C4)[N+](=O)[O-])C

InChI

InChI=1S/C28H27NO5/c1-17-14-23-24(15-18(17)2)34-26(20-8-10-21(11-9-20)28(3,4)5)27(25(23)30)33-16-19-6-12-22(13-7-19)29(31)32/h6-15H,16H2,1-5H3