ethyl (Z)-2-isothiocyanato-3-(4-methoxyphenyl)prop-2-enoate

Systemtic Name: ethyl (Z)-2-isothiocyanato-3-(4-methoxyphenyl)prop-2-enoate Openeye Name: ethyl (Z)-2-isothiocyanato-3-(4-methoxyphenyl)prop-2-enoate CAS Name: (Z)-2-isothiocyanato-3-(4-methoxyphenyl)-2-propenoic acid ethyl ester IUPAC Name: ethyl (Z)-2-isothiocyanato-3-(4-methoxyphenyl)prop-2-enoate Traditional Name: (Z)-2-isothiocyanato-3-(4-methoxyphenyl)acrylic acid ethyl ester Formula: C13H13NO3S MolecularWeight: 263.31222

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CC1=CC=C(C=C1)OC)N=C=S

Isomeric SMILES

CCOC(=O)/C(=C/C1=CC=C(C=C1)OC)/N=C=S

InChI

InChI=1S/C13H13NO3S/c1-3-17-13(15)12(14-9-18)8-10-4-6-11(16-2)7-5-10/h4-8H,3H2,1-2H3/b12-8-