methyl (E)-3-[4-(6-bromanyl-8,9-dihydro-7H-benzo[7]annulen-5-yl)phenyl]prop-2-enoate

Systemtic Name: methyl (E)-3-[4-(6-bromanyl-8,9-dihydro-7H-benzo[7]annulen-5-yl)phenyl]prop-2-enoate Openeye Name: methyl (E)-3-[4-(6-bromo-8,9-dihydro-7H-benzo[7]annulen-5-yl)phenyl]prop-2-enoate CAS Name: (E)-3-[4-(6-bromo-8,9-dihydro-7H-benzo[7]annulen-5-yl)phenyl]-2-propenoic acid methyl ester IUPAC Name: methyl (E)-3-[4-(6-bromo-8,9-dihydro-7H-benzo[7]annulen-5-yl)phenyl]prop-2-enoate Traditional Name: (E)-3-[4-(6-bromo-8,9-dihydro-7H-benzocyclohepten-5-yl)phenyl]acrylic acid methyl ester Formula: C21H19BrO2 MolecularWeight: 383.27836

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C=CC1=CC=C(C=C1)C2=C(CCCC3=CC=CC=C32)Br

Isomeric SMILES

COC(=O)/C=C/C1=CC=C(C=C1)C2=C(CCCC3=CC=CC=C32)Br

InChI

InChI=1S/C21H19BrO2/c1-24-20(23)14-11-15-9-12-17(13-10-15)21-18-7-3-2-5-16(18)6-4-8-19(21)22/h2-3,5,7,9-14H,4,6,8H2,1H3/b14-11+