N-[2-ethyl-3-oxidanylidene-4-(phenylmethyl)-5H-1,4-benzoxazepin-7-yl]-2-phenyl-butanamide

Systemtic Name: N-[2-ethyl-3-oxidanylidene-4-(phenylmethyl)-5H-1,4-benzoxazepin-7-yl]-2-phenyl-butanamide Openeye Name: N-(4-benzyl-2-ethyl-3-oxo-5H-1,4-benzoxazepin-7-yl)-2-phenyl-butanamide CAS Name: N-[2-ethyl-3-oxo-4-(phenylmethyl)-5H-1,4-benzoxazepin-7-yl]-2-phenylbutanamide IUPAC Name: N-(4-benzyl-2-ethyl-3-oxo-5H-1,4-benzoxazepin-7-yl)-2-phenylbutanamide Traditional Name: N-(4-benzyl-2-ethyl-3-keto-5H-1,4-benzoxazepin-7-yl)-2-phenyl-butyramide Formula: C28H30N2O3 MolecularWeight: 442.5494

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=O)N(CC2=C(O1)C=CC(=C2)NC(=O)C(CC)C3=CC=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

CCC1C(=O)N(CC2=C(O1)C=CC(=C2)NC(=O)C(CC)C3=CC=CC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C28H30N2O3/c1-3-24(21-13-9-6-10-14-21)27(31)29-23-15-16-26-22(17-23)19-30(28(32)25(4-2)33-26)18-20-11-7-5-8-12-20/h5-17,24-25H,3-4,18-19H2,1-2H3,(H,29,31)