methyl (E)-3-[3-(1-bromanyl-4-pentoxy-naphthalen-2-yl)phenyl]prop-2-enoate

Systemtic Name: methyl (E)-3-[3-(1-bromanyl-4-pentoxy-naphthalen-2-yl)phenyl]prop-2-enoate Openeye Name: methyl (E)-3-[3-(1-bromo-4-pentoxy-2-naphthyl)phenyl]prop-2-enoate CAS Name: (E)-3-[3-(1-bromo-4-pentoxy-2-naphthalenyl)phenyl]-2-propenoic acid methyl ester IUPAC Name: methyl (E)-3-[3-(1-bromo-4-pentoxynaphthalen-2-yl)phenyl]prop-2-enoate Traditional Name: (E)-3-[3-(4-amoxy-1-bromo-2-naphthyl)phenyl]acrylic acid methyl ester Formula: C25H25BrO3 MolecularWeight: 453.3682

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC(=C(C2=CC=CC=C21)Br)C3=CC(=CC=C3)C=CC(=O)OC

Isomeric SMILES

CCCCCOC1=CC(=C(C2=CC=CC=C21)Br)C3=CC(=CC=C3)/C=C/C(=O)OC

InChI

InChI=1S/C25H25BrO3/c1-3-4-7-15-29-23-17-22(25(26)21-12-6-5-11-20(21)23)19-10-8-9-18(16-19)13-14-24(27)28-2/h5-6,8-14,16-17H,3-4,7,15H2,1-2H3/b14-13+