ethyl 3-[2-[4-(1,3-dithiolan-2-yl)phenoxy]ethanoylamino]benzoate

Systemtic Name: ethyl 3-[2-[4-(1,3-dithiolan-2-yl)phenoxy]ethanoylamino]benzoate Openeye Name: ethyl 3-[[2-[4-(1,3-dithiolan-2-yl)phenoxy]acetyl]amino]benzoate CAS Name: 3-[[2-[4-(1,3-dithiolan-2-yl)phenoxy]-1-oxoethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[[2-[4-(1,3-dithiolan-2-yl)phenoxy]acetyl]amino]benzoate Traditional Name: 3-[[2-[4-(1,3-dithiolan-2-yl)phenoxy]acetyl]amino]benzoic acid ethyl ester Formula: C20H21NO4S2 MolecularWeight: 403.51504

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)NC(=O)COC2=CC=C(C=C2)C3SCCS3

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)NC(=O)COC2=CC=C(C=C2)C3SCCS3

InChI

InChI=1S/C20H21NO4S2/c1-2-24-19(23)15-4-3-5-16(12-15)21-18(22)13-25-17-8-6-14(7-9-17)20-26-10-11-27-20/h3-9,12,20H,2,10-11,13H2,1H3,(H,21,22)