prop-2-enyl 3-(iodanylmethyl)-7-(2-phenylethanoylamino)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

Systemtic Name: prop-2-enyl 3-(iodanylmethyl)-7-(2-phenylethanoylamino)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Openeye Name: allyl 3-(iodomethyl)-7-[(2-phenylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate CAS Name: 3-(iodomethyl)-7-[(1-oxo-2-phenylethyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl 3-(iodomethyl)-7-[(2-phenylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Traditional Name: 3-(iodomethyl)-7-[(2-phenylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid allyl ester Formula: C19H21IN2O3S MolecularWeight: 484.35111

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCOC(=O)C1=C(CSC2N1CC2NC(=O)CC3=CC=CC=C3)CI

Isomeric SMILES

C=CCOC(=O)C1=C(CSC2N1CC2NC(=O)CC3=CC=CC=C3)CI

InChI

InChI=1S/C19H21IN2O3S/c1-2-8-25-19(24)17-14(10-20)12-26-18-15(11-22(17)18)21-16(23)9-13-6-4-3-5-7-13/h2-7,15,18H,1,8-12H2,(H,21,23)