[2-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)-2-oxidanylidene-ethyl] 2-quinolin-8-ylethanoate

Systemtic Name: [2-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)-2-oxidanylidene-ethyl] 2-quinolin-8-ylethanoate Openeye Name: [2-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)-2-oxo-ethyl] 2-(8-quinolyl)acetate CAS Name: 2-(8-quinolinyl)acetic acid [2-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)-2-oxoethyl] ester IUPAC Name: [2-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)-2-oxoethyl] 2-quinolin-8-ylacetate Traditional Name: 2-(8-quinolyl)acetic acid [2-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)-2-keto-ethyl] ester Formula: C27H22N2O3 MolecularWeight: 422.47518

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC=CC=C2N(C3=CC=CC=C31)C(=O)COC(=O)CC4=CC=CC5=C4N=CC=C5

Isomeric SMILES

C1CC2=CC=CC=C2N(C3=CC=CC=C31)C(=O)COC(=O)CC4=CC=CC5=C4N=CC=C5

InChI

InChI=1S/C27H22N2O3/c30-25(18-32-26(31)17-22-10-5-9-21-11-6-16-28-27(21)22)29-23-12-3-1-7-19(23)14-15-20-8-2-4-13-24(20)29/h1-13,16H,14-15,17-18H2