ethyl (Z)-2-isothiocyanato-3-(1-methylindol-3-yl)prop-2-enoate

Systemtic Name: ethyl (Z)-2-isothiocyanato-3-(1-methylindol-3-yl)prop-2-enoate Openeye Name: ethyl (Z)-2-isothiocyanato-3-(1-methylindol-3-yl)prop-2-enoate CAS Name: (Z)-2-isothiocyanato-3-(1-methyl-3-indolyl)-2-propenoic acid ethyl ester IUPAC Name: ethyl (Z)-2-isothiocyanato-3-(1-methylindol-3-yl)prop-2-enoate Traditional Name: (Z)-2-isothiocyanato-3-(1-methylindol-3-yl)acrylic acid ethyl ester Formula: C15H14N2O2S MolecularWeight: 286.34886

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CC1=CN(C2=CC=CC=C21)C)N=C=S

Isomeric SMILES

CCOC(=O)/C(=C/C1=CN(C2=CC=CC=C21)C)/N=C=S

InChI

InChI=1S/C15H14N2O2S/c1-3-19-15(18)13(16-10-20)8-11-9-17(2)14-7-5-4-6-12(11)14/h4-9H,3H2,1-2H3/b13-8-