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

Systemtic Name: 2-(4-tert-butylphenyl)-6-chloranyl-7-methyl-3-[(4-nitrophenyl)methoxy]chromen-4-one Openeye Name: 2-(4-tert-butylphenyl)-6-chloro-7-methyl-3-[(4-nitrophenyl)methoxy]chromen-4-one CAS Name: 2-(4-tert-butylphenyl)-6-chloro-7-methyl-3-[(4-nitrophenyl)methoxy]-1-benzopyran-4-one IUPAC Name: 2-(4-tert-butylphenyl)-6-chloro-7-methyl-3-[(4-nitrophenyl)methoxy]chromen-4-one Traditional Name: 2-(4-tert-butylphenyl)-6-chloro-7-methyl-3-(4-nitrobenzyl)oxy-chromone Formula: C27H24ClNO5 MolecularWeight: 477.93616

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)OC(=C(C2=O)OCC3=CC=C(C=C3)[N+](=O)[O-])C4=CC=C(C=C4)C(C)(C)C)Cl

Isomeric SMILES

CC1=C(C=C2C(=C1)OC(=C(C2=O)OCC3=CC=C(C=C3)[N+](=O)[O-])C4=CC=C(C=C4)C(C)(C)C)Cl

InChI

InChI=1S/C27H24ClNO5/c1-16-13-23-21(14-22(16)28)24(30)26(33-15-17-5-11-20(12-6-17)29(31)32)25(34-23)18-7-9-19(10-8-18)27(2,3)4/h5-14H,15H2,1-4H3