ethyl 2-[3-(tert-butylamino)-1,4-bis(oxidanylidene)naphthalen-2-yl]sulfanylethanoate

Systemtic Name: ethyl 2-[3-(tert-butylamino)-1,4-bis(oxidanylidene)naphthalen-2-yl]sulfanylethanoate Openeye Name: ethyl 2-[[3-(tert-butylamino)-1,4-dioxo-2-naphthyl]sulfanyl]acetate CAS Name: 2-[[3-(tert-butylamino)-1,4-dioxo-2-naphthalenyl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[3-(tert-butylamino)-1,4-dioxonaphthalen-2-yl]sulfanylacetate Traditional Name: 2-[[3-(tert-butylamino)-1,4-diketo-2-naphthyl]thio]acetic acid ethyl ester Formula: C18H21NO4S MolecularWeight: 347.42864

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=C(C(=O)C2=CC=CC=C2C1=O)NC(C)(C)C

Isomeric SMILES

CCOC(=O)CSC1=C(C(=O)C2=CC=CC=C2C1=O)NC(C)(C)C

InChI

InChI=1S/C18H21NO4S/c1-5-23-13(20)10-24-17-14(19-18(2,3)4)15(21)11-8-6-7-9-12(11)16(17)22/h6-9,19H,5,10H2,1-4H3