(E)-1-(4-chloranyl-3-nitro-phenyl)-3-(4-hexoxyphenyl)prop-2-en-1-one

Systemtic Name: (E)-1-(4-chloranyl-3-nitro-phenyl)-3-(4-hexoxyphenyl)prop-2-en-1-one Openeye Name: (E)-1-(4-chloro-3-nitro-phenyl)-3-(4-hexoxyphenyl)prop-2-en-1-one CAS Name: (E)-1-(4-chloro-3-nitrophenyl)-3-(4-hexoxyphenyl)-2-propen-1-one IUPAC Name: (E)-1-(4-chloro-3-nitrophenyl)-3-(4-hexoxyphenyl)prop-2-en-1-one Traditional Name: (E)-1-(4-chloro-3-nitro-phenyl)-3-(4-hexoxyphenyl)prop-2-en-1-one Formula: C21H22ClNO4 MolecularWeight: 387.85668

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)C=CC(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)/C=C/C(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C21H22ClNO4/c1-2-3-4-5-14-27-18-10-6-16(7-11-18)8-13-21(24)17-9-12-19(22)20(15-17)23(25)26/h6-13,15H,2-5,14H2,1H3/b13-8+