methyl (Z)-3-bromanyl-2-isocyano-3-(3-methylphenyl)prop-2-enoate

Systemtic Name: methyl (Z)-3-bromanyl-2-isocyano-3-(3-methylphenyl)prop-2-enoate Openeye Name: methyl (Z)-3-bromo-2-isocyano-3-(m-tolyl)prop-2-enoate CAS Name: (Z)-3-bromo-2-isocyano-3-(3-methylphenyl)-2-propenoic acid methyl ester IUPAC Name: methyl (Z)-3-bromo-2-isocyano-3-(3-methylphenyl)prop-2-enoate Traditional Name: (Z)-3-bromo-2-isocyano-3-(m-tolyl)acrylic acid methyl ester Formula: C12H10BrNO2 MolecularWeight: 280.1173

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=C(C(=O)OC)[N+]#[C-])Br

Isomeric SMILES

CC1=CC=CC(=C1)/C(=C(\C(=O)OC)/[N+]#[C-])/Br

InChI

InChI=1S/C12H10BrNO2/c1-8-5-4-6-9(7-8)10(13)11(14-2)12(15)16-3/h4-7H,1,3H3/b11-10-