(E)-1-(4-methoxyphenyl)-3-(5-nitro-2-undecoxy-phenyl)prop-2-en-1-one

Systemtic Name: (E)-1-(4-methoxyphenyl)-3-(5-nitro-2-undecoxy-phenyl)prop-2-en-1-one Openeye Name: (E)-1-(4-methoxyphenyl)-3-(5-nitro-2-undecoxy-phenyl)prop-2-en-1-one CAS Name: (E)-1-(4-methoxyphenyl)-3-(5-nitro-2-undecoxyphenyl)-2-propen-1-one IUPAC Name: (E)-1-(4-methoxyphenyl)-3-(5-nitro-2-undecoxyphenyl)prop-2-en-1-one Traditional Name: (E)-1-(4-methoxyphenyl)-3-(5-nitro-2-undecoxy-phenyl)prop-2-en-1-one Formula: C27H35NO5 MolecularWeight: 453.5705

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCOC1=C(C=C(C=C1)[N+](=O)[O-])C=CC(=O)C2=CC=C(C=C2)OC

Isomeric SMILES

CCCCCCCCCCCOC1=C(C=C(C=C1)[N+](=O)[O-])/C=C/C(=O)C2=CC=C(C=C2)OC

InChI

InChI=1S/C27H35NO5/c1-3-4-5-6-7-8-9-10-11-20-33-27-19-15-24(28(30)31)21-23(27)14-18-26(29)22-12-16-25(32-2)17-13-22/h12-19,21H,3-11,20H2,1-2H3/b18-14+