N-[2-ethyl-4-[2-(2-methoxyphenyl)ethyl]-3-oxidanylidene-5H-1,4-benzoxazepin-7-yl]benzamide

Systemtic Name: N-[2-ethyl-4-[2-(2-methoxyphenyl)ethyl]-3-oxidanylidene-5H-1,4-benzoxazepin-7-yl]benzamide Openeye Name: N-[2-ethyl-4-[2-(2-methoxyphenyl)ethyl]-3-oxo-5H-1,4-benzoxazepin-7-yl]benzamide CAS Name: N-[2-ethyl-4-[2-(2-methoxyphenyl)ethyl]-3-oxo-5H-1,4-benzoxazepin-7-yl]benzamide IUPAC Name: N-[2-ethyl-4-[2-(2-methoxyphenyl)ethyl]-3-oxo-5H-1,4-benzoxazepin-7-yl]benzamide Traditional Name: N-[2-ethyl-3-keto-4-[2-(2-methoxyphenyl)ethyl]-5H-1,4-benzoxazepin-7-yl]benzamide Formula: C27H28N2O4 MolecularWeight: 444.52222

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=O)N(CC2=C(O1)C=CC(=C2)NC(=O)C3=CC=CC=C3)CCC4=CC=CC=C4OC

Isomeric SMILES

CCC1C(=O)N(CC2=C(O1)C=CC(=C2)NC(=O)C3=CC=CC=C3)CCC4=CC=CC=C4OC

InChI

InChI=1S/C27H28N2O4/c1-3-23-27(31)29(16-15-19-9-7-8-12-24(19)32-2)18-21-17-22(13-14-25(21)33-23)28-26(30)20-10-5-4-6-11-20/h4-14,17,23H,3,15-16,18H2,1-2H3,(H,28,30)