2-[7-chloranyl-5-(2-fluorophenyl)-2-oxidanylidene-3H-1,4-benzodiazepin-1-yl]ethylsulfamic acid

Systemtic Name: 2-[7-chloranyl-5-(2-fluorophenyl)-2-oxidanylidene-3H-1,4-benzodiazepin-1-yl]ethylsulfamic acid Openeye Name: 2-[7-chloro-5-(2-fluorophenyl)-2-oxo-3H-1,4-benzodiazepin-1-yl]ethylsulfamic acid CAS Name: 2-[7-chloro-5-(2-fluorophenyl)-2-oxo-3H-1,4-benzodiazepin-1-yl]ethylsulfamic acid IUPAC Name: 2-[7-chloro-5-(2-fluorophenyl)-2-oxo-3H-1,4-benzodiazepin-1-yl]ethylsulfamic acid Traditional Name: 2-[7-chloro-5-(2-fluorophenyl)-2-keto-3H-1,4-benzodiazepin-1-yl]ethylsulfamic acid Formula: C17H15ClFN3O4S MolecularWeight: 411.835103

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)N(C2=C(C=C(C=C2)Cl)C(=N1)C3=CC=CC=C3F)CCNS(=O)(=O)O

Isomeric SMILES

C1C(=O)N(C2=C(C=C(C=C2)Cl)C(=N1)C3=CC=CC=C3F)CCNS(=O)(=O)O

InChI

InChI=1S/C17H15ClFN3O4S/c18-11-5-6-15-13(9-11)17(12-3-1-2-4-14(12)19)20-10-16(23)22(15)8-7-21-27(24,25)26/h1-6,9,21H,7-8,10H2,(H,24,25,26)