methyl (E)-3-(3-cyanoindol-1-yl)prop-2-enoate

Systemtic Name: methyl (E)-3-(3-cyanoindol-1-yl)prop-2-enoate Openeye Name: methyl (E)-3-(3-cyanoindol-1-yl)prop-2-enoate CAS Name: (E)-3-(3-cyano-1-indolyl)-2-propenoic acid methyl ester IUPAC Name: methyl (E)-3-(3-cyanoindol-1-yl)prop-2-enoate Traditional Name: (E)-3-(3-cyanoindol-1-yl)acrylic acid methyl ester Formula: C13H10N2O2 MolecularWeight: 226.2307

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C=CN1C=C(C2=CC=CC=C21)C#N

Isomeric SMILES

COC(=O)/C=C/N1C=C(C2=CC=CC=C21)C#N

InChI

InChI=1S/C13H10N2O2/c1-17-13(16)6-7-15-9-10(8-14)11-4-2-3-5-12(11)15/h2-7,9H,1H3/b7-6+