(1-carbazol-9-yl-1-oxidanylidene-propan-2-yl) 4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylate

Systemtic Name: (1-carbazol-9-yl-1-oxidanylidene-propan-2-yl) 4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylate Openeye Name: (2-carbazol-9-yl-1-methyl-2-oxo-ethyl) 4,5,6,7-tetrahydrobenzothiophene-2-carboxylate CAS Name: 4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylic acid [1-(9-carbazolyl)-1-oxopropan-2-yl] ester IUPAC Name: (1-carbazol-9-yl-1-oxopropan-2-yl) 4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylate Traditional Name: 4,5,6,7-tetrahydrobenzothiophene-2-carboxylic acid (2-carbazol-9-yl-2-keto-1-methyl-ethyl) ester Formula: C24H21NO3S MolecularWeight: 403.49344

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1C2=CC=CC=C2C3=CC=CC=C31)OC(=O)C4=CC5=C(S4)CCCC5

Isomeric SMILES

CC(C(=O)N1C2=CC=CC=C2C3=CC=CC=C31)OC(=O)C4=CC5=C(S4)CCCC5

InChI

InChI=1S/C24H21NO3S/c1-15(28-24(27)22-14-16-8-2-7-13-21(16)29-22)23(26)25-19-11-5-3-9-17(19)18-10-4-6-12-20(18)25/h3-6,9-12,14-15H,2,7-8,13H2,1H3