(E)-1-(2,2-dimethyl-7-oxidanyl-3,4-dihydrochromen-6-yl)-3-(3-nitrophenyl)prop-2-en-1-one

Systemtic Name: (E)-1-(2,2-dimethyl-7-oxidanyl-3,4-dihydrochromen-6-yl)-3-(3-nitrophenyl)prop-2-en-1-one Openeye Name: (E)-1-(7-hydroxy-2,2-dimethyl-chroman-6-yl)-3-(3-nitrophenyl)prop-2-en-1-one CAS Name: (E)-1-(7-hydroxy-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-6-yl)-3-(3-nitrophenyl)-2-propen-1-one IUPAC Name: (E)-1-(7-hydroxy-2,2-dimethyl-3,4-dihydrochromen-6-yl)-3-(3-nitrophenyl)prop-2-en-1-one Traditional Name: (E)-1-(7-hydroxy-2,2-dimethyl-chroman-6-yl)-3-(3-nitrophenyl)prop-2-en-1-one Formula: C20H19NO5 MolecularWeight: 353.36856

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC2=C(O1)C=C(C(=C2)C(=O)C=CC3=CC(=CC=C3)[N+](=O)[O-])O)C

Isomeric SMILES

CC1(CCC2=C(O1)C=C(C(=C2)C(=O)/C=C/C3=CC(=CC=C3)[N+](=O)[O-])O)C

InChI

InChI=1S/C20H19NO5/c1-20(2)9-8-14-11-16(18(23)12-19(14)26-20)17(22)7-6-13-4-3-5-15(10-13)21(24)25/h3-7,10-12,23H,8-9H2,1-2H3/b7-6+