methyl (E)-3-(5-bromanyl-1-ethanoyl-indol-3-yl)prop-2-enoate

Systemtic Name: methyl (E)-3-(5-bromanyl-1-ethanoyl-indol-3-yl)prop-2-enoate Openeye Name: methyl (E)-3-(1-acetyl-5-bromo-indol-3-yl)prop-2-enoate CAS Name: (E)-3-(1-acetyl-5-bromo-3-indolyl)-2-propenoic acid methyl ester IUPAC Name: methyl (E)-3-(1-acetyl-5-bromoindol-3-yl)prop-2-enoate Traditional Name: (E)-3-(1-acetyl-5-bromo-indol-3-yl)acrylic acid methyl ester Formula: C14H12BrNO3 MolecularWeight: 322.15398

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C=C(C2=C1C=CC(=C2)Br)C=CC(=O)OC

Isomeric SMILES

CC(=O)N1C=C(C2=C1C=CC(=C2)Br)/C=C/C(=O)OC

InChI

InChI=1S/C14H12BrNO3/c1-9(17)16-8-10(3-6-14(18)19-2)12-7-11(15)4-5-13(12)16/h3-8H,1-2H3/b6-3+