[1-(3,4-dihydro-2H-quinolin-1-yl)-1-oxidanylidene-butan-2-yl] 4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylate

Systemtic Name: [1-(3,4-dihydro-2H-quinolin-1-yl)-1-oxidanylidene-butan-2-yl] 4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylate Openeye Name: 1-(3,4-dihydro-2H-quinoline-1-carbonyl)propyl 4,5,6,7-tetrahydrobenzothiophene-2-carboxylate CAS Name: 4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylic acid [1-(3,4-dihydro-2H-quinolin-1-yl)-1-oxobutan-2-yl] ester IUPAC Name: [1-(3,4-dihydro-2H-quinolin-1-yl)-1-oxobutan-2-yl] 4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylate Traditional Name: 4,5,6,7-tetrahydrobenzothiophene-2-carboxylic acid 1-(3,4-dihydro-2H-quinoline-1-carbonyl)propyl ester Formula: C22H25NO3S MolecularWeight: 383.5038

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)N1CCCC2=CC=CC=C21)OC(=O)C3=CC4=C(S3)CCCC4

Isomeric SMILES

CCC(C(=O)N1CCCC2=CC=CC=C21)OC(=O)C3=CC4=C(S3)CCCC4

InChI

InChI=1S/C22H25NO3S/c1-2-18(21(24)23-13-7-10-15-8-3-5-11-17(15)23)26-22(25)20-14-16-9-4-6-12-19(16)27-20/h3,5,8,11,14,18H,2,4,6-7,9-10,12-13H2,1H3