ethyl 3-[(E)-N-(methoxycarbonylamino)-C-(naphthalen-2-ylmethyl)carbonimidoyl]sulfanylpropanoate

Systemtic Name: ethyl 3-[(E)-N-(methoxycarbonylamino)-C-(naphthalen-2-ylmethyl)carbonimidoyl]sulfanylpropanoate Openeye Name: ethyl 3-[(E)-N-(methoxycarbonylamino)-C-(2-naphthylmethyl)carbonimidoyl]sulfanylpropanoate CAS Name: 3-[[(1E)-1-(methoxycarbonylhydrazinylidene)-2-(2-naphthalenyl)ethyl]thio]propanoic acid ethyl ester IUPAC Name: ethyl 3-[(E)-N-(methoxycarbonylamino)-C-(naphthalen-2-ylmethyl)carbonimidoyl]sulfanylpropanoate Traditional Name: 3-[[(E)-N-(carbomethoxyamino)-C-(2-naphthylmethyl)carbonimidoyl]thio]propionic acid ethyl ester Formula: C19H22N2O4S MolecularWeight: 374.45398

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCSC(=NNC(=O)OC)CC1=CC2=CC=CC=C2C=C1

Isomeric SMILES

CCOC(=O)CCS/C(=N/NC(=O)OC)/CC1=CC2=CC=CC=C2C=C1

InChI

InChI=1S/C19H22N2O4S/c1-3-25-18(22)10-11-26-17(20-21-19(23)24-2)13-14-8-9-15-6-4-5-7-16(15)12-14/h4-9,12H,3,10-11,13H2,1-2H3,(H,21,23)/b20-17+