ethyl 4-cyclohexyl-2-[(4-oxidanylidene-3,5-dihydro-2H-1,5-benzoxazepin-3-yl)amino]butanoate

Systemtic Name: ethyl 4-cyclohexyl-2-[(4-oxidanylidene-3,5-dihydro-2H-1,5-benzoxazepin-3-yl)amino]butanoate Openeye Name: ethyl 4-cyclohexyl-2-[(4-oxo-3,5-dihydro-2H-1,5-benzoxazepin-3-yl)amino]butanoate CAS Name: 4-cyclohexyl-2-[(4-oxo-3,5-dihydro-2H-1,5-benzoxazepin-3-yl)amino]butanoic acid ethyl ester IUPAC Name: ethyl 4-cyclohexyl-2-[(4-oxo-3,5-dihydro-2H-1,5-benzoxazepin-3-yl)amino]butanoate Traditional Name: 4-cyclohexyl-2-[(4-keto-3,5-dihydro-2H-1,5-benzoxazepin-3-yl)amino]butyric acid ethyl ester Formula: C21H30N2O4 MolecularWeight: 374.4739

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCC1CCCCC1)NC2COC3=CC=CC=C3NC2=O

Isomeric SMILES

CCOC(=O)C(CCC1CCCCC1)NC2COC3=CC=CC=C3NC2=O

InChI

InChI=1S/C21H30N2O4/c1-2-26-21(25)17(13-12-15-8-4-3-5-9-15)22-18-14-27-19-11-7-6-10-16(19)23-20(18)24/h6-7,10-11,15,17-18,22H,2-5,8-9,12-14H2,1H3,(H,23,24)