(2-oxidanylidene-1,3,4,5-tetrahydro-1-benzazepin-5-yl) 3-(quinolin-2-ylmethoxy)benzoate

Systemtic Name: (2-oxidanylidene-1,3,4,5-tetrahydro-1-benzazepin-5-yl) 3-(quinolin-2-ylmethoxy)benzoate Openeye Name: (2-oxo-1,3,4,5-tetrahydro-1-benzazepin-5-yl) 3-(2-quinolylmethoxy)benzoate CAS Name: 3-(2-quinolinylmethoxy)benzoic acid (2-oxo-1,3,4,5-tetrahydro-1-benzazepin-5-yl) ester IUPAC Name: (2-oxo-1,3,4,5-tetrahydro-1-benzazepin-5-yl) 3-(quinolin-2-ylmethoxy)benzoate Traditional Name: 3-(2-quinolylmethoxy)benzoic acid (2-keto-1,3,4,5-tetrahydro-1-benzazepin-5-yl) ester Formula: C27H22N2O4 MolecularWeight: 438.47458

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)NC2=CC=CC=C2C1OC(=O)C3=CC(=CC=C3)OCC4=NC5=CC=CC=C5C=C4

Isomeric SMILES

C1CC(=O)NC2=CC=CC=C2C1OC(=O)C3=CC(=CC=C3)OCC4=NC5=CC=CC=C5C=C4

InChI

InChI=1S/C27H22N2O4/c30-26-15-14-25(22-9-2-4-11-24(22)29-26)33-27(31)19-7-5-8-21(16-19)32-17-20-13-12-18-6-1-3-10-23(18)28-20/h1-13,16,25H,14-15,17H2,(H,29,30)