ethyl 6,9-dimethylbenzo[b][1,4]benzoxazepine-3-carboxylate

Systemtic Name: ethyl 6,9-dimethylbenzo[b][1,4]benzoxazepine-3-carboxylate Openeye Name: ethyl 6,9-dimethylbenzo[b][1,4]benzoxazepine-3-carboxylate CAS Name: 6,9-dimethyl-3-benzo[b][1,4]benzoxazepinecarboxylic acid ethyl ester IUPAC Name: ethyl 6,9-dimethylbenzo[b][1,4]benzoxazepine-3-carboxylate Traditional Name: 6,9-dimethylbenzo[b][1,4]benzoxazepine-3-carboxylic acid ethyl ester Formula: C18H17NO3 MolecularWeight: 295.33248

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(C=C1)OC3=C(C=CC(=C3)C)C(=N2)C

Isomeric SMILES

CCOC(=O)C1=CC2=C(C=C1)OC3=C(C=CC(=C3)C)C(=N2)C

InChI

InChI=1S/C18H17NO3/c1-4-21-18(20)13-6-8-16-15(10-13)19-12(3)14-7-5-11(2)9-17(14)22-16/h5-10H,4H2,1-3H3