methyl 2-[(Z)-1-(2-bromanyl-3-nitro-phenyl)-3-methoxy-3-oxidanylidene-prop-1-en-2-yl]benzoate

Systemtic Name: methyl 2-[(Z)-1-(2-bromanyl-3-nitro-phenyl)-3-methoxy-3-oxidanylidene-prop-1-en-2-yl]benzoate Openeye Name: methyl 2-[(Z)-2-(2-bromo-3-nitro-phenyl)-1-methoxycarbonyl-vinyl]benzoate CAS Name: 2-[(Z)-1-(2-bromo-3-nitrophenyl)-3-methoxy-3-oxoprop-1-en-2-yl]benzoic acid methyl ester IUPAC Name: methyl 2-[(Z)-1-(2-bromo-3-nitrophenyl)-3-methoxy-3-oxoprop-1-en-2-yl]benzoate Traditional Name: 2-[(Z)-2-(2-bromo-3-nitro-phenyl)-1-carbomethoxy-vinyl]benzoic acid methyl ester Formula: C18H14BrNO6 MolecularWeight: 420.21086

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1C(=CC2=C(C(=CC=C2)[N+](=O)[O-])Br)C(=O)OC

Isomeric SMILES

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

InChI

InChI=1S/C18H14BrNO6/c1-25-17(21)13-8-4-3-7-12(13)14(18(22)26-2)10-11-6-5-9-15(16(11)19)20(23)24/h3-10H,1-2H3/b14-10-