(E)-1-(4-nitrophenyl)-3-(4-octadecoxyphenyl)prop-2-en-1-one

Systemtic Name: (E)-1-(4-nitrophenyl)-3-(4-octadecoxyphenyl)prop-2-en-1-one Openeye Name: (E)-1-(4-nitrophenyl)-3-(4-octadecoxyphenyl)prop-2-en-1-one CAS Name: (E)-1-(4-nitrophenyl)-3-(4-octadecoxyphenyl)-2-propen-1-one IUPAC Name: (E)-1-(4-nitrophenyl)-3-(4-octadecoxyphenyl)prop-2-en-1-one Traditional Name: (E)-1-(4-nitrophenyl)-3-(4-stearyloxyphenyl)prop-2-en-1-one Formula: C33H47NO4 MolecularWeight: 521.73058

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC1=CC=C(C=C1)C=CC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC1=CC=C(C=C1)/C=C/C(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C33H47NO4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-28-38-32-25-18-29(19-26-32)20-27-33(35)30-21-23-31(24-22-30)34(36)37/h18-27H,2-17,28H2,1H3/b27-20+