3-(2-phenyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)-N-(quinolin-6-ylmethyl)propanamide

Systemtic Name: 3-(2-phenyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)-N-(quinolin-6-ylmethyl)propanamide Openeye Name: 3-(2-phenyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)-N-(6-quinolylmethyl)propanamide CAS Name: 3-(2-phenyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)-N-(6-quinolinylmethyl)propanamide IUPAC Name: 3-(2-phenyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)-N-(quinolin-6-ylmethyl)propanamide Traditional Name: 3-(2-phenyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)-N-(6-quinolylmethyl)propionamide Formula: C28H27N3O2 MolecularWeight: 437.53288

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=CC=CC=C2CN1CCC(=O)NCC3=CC4=C(C=C3)N=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1C(OC2=CC=CC=C2CN1CCC(=O)NCC3=CC4=C(C=C3)N=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C28H27N3O2/c32-28(30-18-21-12-13-25-23(17-21)10-6-15-29-25)14-16-31-19-24-9-4-5-11-26(24)33-27(20-31)22-7-2-1-3-8-22/h1-13,15,17,27H,14,16,18-20H2,(H,30,32)