methyl (2E)-7-chloranyl-5-(2-fluorophenyl)-N-methoxy-3H-1,4-benzodiazepine-2-carboximidate

Systemtic Name: methyl (2E)-7-chloranyl-5-(2-fluorophenyl)-N-methoxy-3H-1,4-benzodiazepine-2-carboximidate Openeye Name: methyl (2E)-7-chloro-5-(2-fluorophenyl)-N-methoxy-3H-1,4-benzodiazepine-2-carboximidate CAS Name: (2E)-7-chloro-5-(2-fluorophenyl)-N-methoxy-3H-1,4-benzodiazepine-2-carboximidic acid methyl ester IUPAC Name: methyl (2E)-7-chloro-5-(2-fluorophenyl)-N-methoxy-3H-1,4-benzodiazepine-2-carboximidate Traditional Name: (2E)-7-chloro-5-(2-fluorophenyl)-N-methoxy-3H-1,4-benzodiazepine-2-carboximidic acid methyl ester Formula: C18H15ClFN3O2 MolecularWeight: 359.782003

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Descriptors Computed from Structure

Canonical SMILES:

COC(=NOC)C1=NC2=C(C=C(C=C2)Cl)C(=NC1)C3=CC=CC=C3F

Isomeric SMILES

CO/C(=N/OC)/C1=NC2=C(C=C(C=C2)Cl)C(=NC1)C3=CC=CC=C3F

InChI

InChI=1S/C18H15ClFN3O2/c1-24-18(23-25-2)16-10-21-17(12-5-3-4-6-14(12)20)13-9-11(19)7-8-15(13)22-16/h3-9H,10H2,1-2H3/b23-18+