ethyl 3-[(E)-N-(methoxycarbonylamino)-C-[(3-methoxyphenyl)methyl]carbonimidoyl]sulfanylpropanoate

Systemtic Name: ethyl 3-[(E)-N-(methoxycarbonylamino)-C-[(3-methoxyphenyl)methyl]carbonimidoyl]sulfanylpropanoate Openeye Name: ethyl 3-[(E)-N-(methoxycarbonylamino)-C-[(3-methoxyphenyl)methyl]carbonimidoyl]sulfanylpropanoate CAS Name: 3-[[(1E)-1-(methoxycarbonylhydrazinylidene)-2-(3-methoxyphenyl)ethyl]thio]propanoic acid ethyl ester IUPAC Name: ethyl 3-[(E)-N-(methoxycarbonylamino)-C-[(3-methoxyphenyl)methyl]carbonimidoyl]sulfanylpropanoate Traditional Name: 3-[[(E)-N-(carbomethoxyamino)-C-m-anisyl-carbonimidoyl]thio]propionic acid ethyl ester Formula: C16H22N2O5S MolecularWeight: 354.42128

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCSC(=NNC(=O)OC)CC1=CC(=CC=C1)OC

Isomeric SMILES

CCOC(=O)CCS/C(=N/NC(=O)OC)/CC1=CC(=CC=C1)OC

InChI

InChI=1S/C16H22N2O5S/c1-4-23-15(19)8-9-24-14(17-18-16(20)22-3)11-12-6-5-7-13(10-12)21-2/h5-7,10H,4,8-9,11H2,1-3H3,(H,18,20)/b17-14+