[2-(1-naphthalen-1-ylethylamino)-2-oxidanylidene-ethyl] 4-(1,3-dithiolan-2-yl)benzoate

Systemtic Name: [2-(1-naphthalen-1-ylethylamino)-2-oxidanylidene-ethyl] 4-(1,3-dithiolan-2-yl)benzoate Openeye Name: [2-[1-(1-naphthyl)ethylamino]-2-oxo-ethyl] 4-(1,3-dithiolan-2-yl)benzoate CAS Name: 4-(1,3-dithiolan-2-yl)benzoic acid [2-[1-(1-naphthalenyl)ethylamino]-2-oxoethyl] ester IUPAC Name: [2-(1-naphthalen-1-ylethylamino)-2-oxoethyl] 4-(1,3-dithiolan-2-yl)benzoate Traditional Name: 4-(1,3-dithiolan-2-yl)benzoic acid [2-keto-2-[1-(1-naphthyl)ethylamino]ethyl] ester Formula: C24H23NO3S2 MolecularWeight: 437.57432

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC2=CC=CC=C21)NC(=O)COC(=O)C3=CC=C(C=C3)C4SCCS4

Isomeric SMILES

CC(C1=CC=CC2=CC=CC=C21)NC(=O)COC(=O)C3=CC=C(C=C3)C4SCCS4

InChI

InChI=1S/C24H23NO3S2/c1-16(20-8-4-6-17-5-2-3-7-21(17)20)25-22(26)15-28-23(27)18-9-11-19(12-10-18)24-29-13-14-30-24/h2-12,16,24H,13-15H2,1H3,(H,25,26)