4-[(4E)-7-methyl-4-[(4-nitrophenyl)methylidene]-3,5-dihydro-2H-1-benzoxepin-5-yl]phenol

Systemtic Name: 4-[(4E)-7-methyl-4-[(4-nitrophenyl)methylidene]-3,5-dihydro-2H-1-benzoxepin-5-yl]phenol Openeye Name: 4-[(4E)-7-methyl-4-[(4-nitrophenyl)methylene]-3,5-dihydro-2H-1-benzoxepin-5-yl]phenol CAS Name: 4-[(4E)-7-methyl-4-[(4-nitrophenyl)methylidene]-3,5-dihydro-2H-1-benzoxepin-5-yl]phenol IUPAC Name: 4-[(4E)-7-methyl-4-[(4-nitrophenyl)methylidene]-3,5-dihydro-2H-1-benzoxepin-5-yl]phenol Traditional Name: 4-[(4E)-7-methyl-4-(4-nitrobenzylidene)-3,5-dihydro-2H-1-benzoxepin-5-yl]phenol Formula: C24H21NO4 MolecularWeight: 387.42784

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OCCC(=CC3=CC=C(C=C3)[N+](=O)[O-])C2C4=CC=C(C=C4)O

Isomeric SMILES

CC1=CC2=C(C=C1)OCC/C(=C\C3=CC=C(C=C3)[N+](=O)[O-])/C2C4=CC=C(C=C4)O

InChI

InChI=1S/C24H21NO4/c1-16-2-11-23-22(14-16)24(18-5-9-21(26)10-6-18)19(12-13-29-23)15-17-3-7-20(8-4-17)25(27)28/h2-11,14-15,24,26H,12-13H2,1H3/b19-15+