ethyl 4-[(3-chloranyl-6-oxidanylidene-5H-benzo[b][1,4]benzoxazepin-8-yl)amino]-4-oxidanylidene-butanoate

Systemtic Name: ethyl 4-[(3-chloranyl-6-oxidanylidene-5H-benzo[b][1,4]benzoxazepin-8-yl)amino]-4-oxidanylidene-butanoate Openeye Name: ethyl 4-[(3-chloro-6-oxo-5H-benzo[b][1,4]benzoxazepin-8-yl)amino]-4-oxo-butanoate CAS Name: 4-[(3-chloro-6-oxo-5H-benzo[b][1,4]benzoxazepin-8-yl)amino]-4-oxobutanoic acid ethyl ester IUPAC Name: ethyl 4-[(3-chloro-6-oxo-5H-benzo[b][1,4]benzoxazepin-8-yl)amino]-4-oxobutanoate Traditional Name: 4-[(3-chloro-6-keto-5H-benzo[b][1,4]benzoxazepin-8-yl)amino]-4-keto-butyric acid ethyl ester Formula: C19H17ClN2O5 MolecularWeight: 388.80168

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(=O)NC1=CC2=C(C=C1)OC3=C(C=C(C=C3)Cl)NC2=O

Isomeric SMILES

CCOC(=O)CCC(=O)NC1=CC2=C(C=C1)OC3=C(C=C(C=C3)Cl)NC2=O

InChI

InChI=1S/C19H17ClN2O5/c1-2-26-18(24)8-7-17(23)21-12-4-6-15-13(10-12)19(25)22-14-9-11(20)3-5-16(14)27-15/h3-6,9-10H,2,7-8H2,1H3,(H,21,23)(H,22,25)