2-[7-chloranyl-1-(2,2-dimethyl-3-morpholin-4-yl-propyl)-5-naphthalen-1-yl-2-oxidanylidene-5H-4,1-benzoxazepin-3-yl]ethanoate

Systemtic Name: 2-[7-chloranyl-1-(2,2-dimethyl-3-morpholin-4-yl-propyl)-5-naphthalen-1-yl-2-oxidanylidene-5H-4,1-benzoxazepin-3-yl]ethanoate Openeye Name: 2-[7-chloro-1-(2,2-dimethyl-3-morpholino-propyl)-5-(1-naphthyl)-2-oxo-5H-4,1-benzoxazepin-3-yl]acetate CAS Name: 2-[7-chloro-1-[2,2-dimethyl-3-(4-morpholinyl)propyl]-5-(1-naphthalenyl)-2-oxo-5H-4,1-benzoxazepin-3-yl]acetate IUPAC Name: 2-[7-chloro-1-(2,2-dimethyl-3-morpholin-4-ylpropyl)-5-naphthalen-1-yl-2-oxo-5H-4,1-benzoxazepin-3-yl]acetate Traditional Name: 2-[7-chloro-1-(2,2-dimethyl-3-morpholino-propyl)-2-keto-5-(1-naphthyl)-5H-4,1-benzoxazepin-3-yl]acetate Formula: C30H32ClN2O5- MolecularWeight: 536.03848

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CN1CCOCC1)CN2C3=C(C=C(C=C3)Cl)C(OC(C2=O)CC(=O)[O-])C4=CC=CC5=CC=CC=C54

Isomeric SMILES

CC(C)(CN1CCOCC1)CN2C3=C(C=C(C=C3)Cl)C(OC(C2=O)CC(=O)[O-])C4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C30H33ClN2O5/c1-30(2,18-32-12-14-37-15-13-32)19-33-25-11-10-21(31)16-24(25)28(38-26(29(33)36)17-27(34)35)23-9-5-7-20-6-3-4-8-22(20)23/h3-11,16,26,28H,12-15,17-19H2,1-2H3,(H,34,35)/p-1