[(1S)-2-oxidanylidenecyclohexyl] (4Z)-4-(thiophen-2-ylmethylidene)-2,3-dihydro-1H-acridine-9-carboxylate

Systemtic Name: [(1S)-2-oxidanylidenecyclohexyl] (4Z)-4-(thiophen-2-ylmethylidene)-2,3-dihydro-1H-acridine-9-carboxylate Openeye Name: [(1S)-2-oxocyclohexyl] (4Z)-4-(2-thienylmethylene)-2,3-dihydro-1H-acridine-9-carboxylate CAS Name: (4Z)-4-(thiophen-2-ylmethylidene)-2,3-dihydro-1H-acridine-9-carboxylic acid [(1S)-2-oxocyclohexyl] ester IUPAC Name: [(1S)-2-oxocyclohexyl] (4Z)-4-(thiophen-2-ylmethylidene)-2,3-dihydro-1H-acridine-9-carboxylate Traditional Name: (4Z)-4-(2-thenylidene)-2,3-dihydro-1H-acridine-9-carboxylic acid [(1S)-2-ketocyclohexyl] ester Formula: C25H23NO3S MolecularWeight: 417.52002

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)C(C1)OC(=O)C2=C3CCCC(=CC4=CC=CS4)C3=NC5=CC=CC=C52

Isomeric SMILES

C1CCC(=O)[C@H](C1)OC(=O)C2=C3CCC/C(=C/C4=CC=CS4)/C3=NC5=CC=CC=C52

InChI

InChI=1S/C25H23NO3S/c27-21-12-3-4-13-22(21)29-25(28)23-18-9-1-2-11-20(18)26-24-16(7-5-10-19(23)24)15-17-8-6-14-30-17/h1-2,6,8-9,11,14-15,22H,3-5,7,10,12-13H2/b16-15-/t22-/m0/s1