ethyl N-[4-methyl-1-[2-(4-oxidanylidene-2,3-dihydro-1,5-benzoxazepin-5-yl)ethanoylamino]pentan-2-yl]carbamate

Systemtic Name: ethyl N-[4-methyl-1-[2-(4-oxidanylidene-2,3-dihydro-1,5-benzoxazepin-5-yl)ethanoylamino]pentan-2-yl]carbamate Openeye Name: ethyl N-[3-methyl-1-[[[2-(4-oxo-2,3-dihydro-1,5-benzoxazepin-5-yl)acetyl]amino]methyl]butyl]carbamate CAS Name: N-[4-methyl-1-[[1-oxo-2-(4-oxo-2,3-dihydro-1,5-benzoxazepin-5-yl)ethyl]amino]pentan-2-yl]carbamic acid ethyl ester IUPAC Name: ethyl N-[4-methyl-1-[[2-(4-oxo-2,3-dihydro-1,5-benzoxazepin-5-yl)acetyl]amino]pentan-2-yl]carbamate Traditional Name: N-[1-[[[2-(4-keto-2,3-dihydro-1,5-benzoxazepin-5-yl)acetyl]amino]methyl]-3-methyl-butyl]carbamic acid ethyl ester Formula: C20H29N3O5 MolecularWeight: 391.46136

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC(CC(C)C)CNC(=O)CN1C(=O)CCOC2=CC=CC=C21

Isomeric SMILES

CCOC(=O)NC(CC(C)C)CNC(=O)CN1C(=O)CCOC2=CC=CC=C21

InChI

InChI=1S/C20H29N3O5/c1-4-27-20(26)22-15(11-14(2)3)12-21-18(24)13-23-16-7-5-6-8-17(16)28-10-9-19(23)25/h5-8,14-15H,4,9-13H2,1-3H3,(H,21,24)(H,22,26)