[2-(3,4-dihydro-2H-chromen-4-ylamino)-2-oxidanylidene-ethyl] 5-methylthiophene-2-carboxylate

Systemtic Name: [2-(3,4-dihydro-2H-chromen-4-ylamino)-2-oxidanylidene-ethyl] 5-methylthiophene-2-carboxylate Openeye Name: [2-(chroman-4-ylamino)-2-oxo-ethyl] 5-methylthiophene-2-carboxylate CAS Name: 5-methyl-2-thiophenecarboxylic acid [2-(3,4-dihydro-2H-1-benzopyran-4-ylamino)-2-oxoethyl] ester IUPAC Name: [2-(3,4-dihydro-2H-chromen-4-ylamino)-2-oxoethyl] 5-methylthiophene-2-carboxylate Traditional Name: 5-methylthiophene-2-carboxylic acid [2-(chroman-4-ylamino)-2-keto-ethyl] ester Formula: C17H17NO4S MolecularWeight: 331.38618

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C(=O)OCC(=O)NC2CCOC3=CC=CC=C23

Isomeric SMILES

CC1=CC=C(S1)C(=O)OCC(=O)NC2CCOC3=CC=CC=C23

InChI

InChI=1S/C17H17NO4S/c1-11-6-7-15(23-11)17(20)22-10-16(19)18-13-8-9-21-14-5-3-2-4-12(13)14/h2-7,13H,8-10H2,1H3,(H,18,19)