(E)-1-(5-bromanylthiophen-2-yl)-3-(3-methoxy-5-nitro-4-oxidanyl-phenyl)prop-2-en-1-one

Systemtic Name: (E)-1-(5-bromanylthiophen-2-yl)-3-(3-methoxy-5-nitro-4-oxidanyl-phenyl)prop-2-en-1-one Openeye Name: (E)-1-(5-bromo-2-thienyl)-3-(4-hydroxy-3-methoxy-5-nitro-phenyl)prop-2-en-1-one CAS Name: (E)-1-(5-bromo-2-thiophenyl)-3-(4-hydroxy-3-methoxy-5-nitrophenyl)-2-propen-1-one IUPAC Name: (E)-1-(5-bromothiophen-2-yl)-3-(4-hydroxy-3-methoxy-5-nitrophenyl)prop-2-en-1-one Traditional Name: (E)-1-(5-bromo-2-thienyl)-3-(4-hydroxy-3-methoxy-5-nitro-phenyl)prop-2-en-1-one Formula: C14H10BrNO5S MolecularWeight: 384.2019

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1O)[N+](=O)[O-])C=CC(=O)C2=CC=C(S2)Br

Isomeric SMILES

COC1=CC(=CC(=C1O)[N+](=O)[O-])/C=C/C(=O)C2=CC=C(S2)Br

InChI

InChI=1S/C14H10BrNO5S/c1-21-11-7-8(6-9(14(11)18)16(19)20)2-3-10(17)12-4-5-13(15)22-12/h2-7,18H,1H3/b3-2+