1-(cyclopropylmethyl)-3-fluoranyl-5-(2-fluorophenyl)-7-nitro-3H-1,4-benzodiazepin-2-one

Systemtic Name: 1-(cyclopropylmethyl)-3-fluoranyl-5-(2-fluorophenyl)-7-nitro-3H-1,4-benzodiazepin-2-one Openeye Name: 1-(cyclopropylmethyl)-3-fluoro-5-(2-fluorophenyl)-7-nitro-3H-1,4-benzodiazepin-2-one CAS Name: 1-(cyclopropylmethyl)-3-fluoro-5-(2-fluorophenyl)-7-nitro-3H-1,4-benzodiazepin-2-one IUPAC Name: 1-(cyclopropylmethyl)-3-fluoro-5-(2-fluorophenyl)-7-nitro-3H-1,4-benzodiazepin-2-one Traditional Name: 1-(cyclopropylmethyl)-3-fluoro-5-(2-fluorophenyl)-7-nitro-3H-1,4-benzodiazepin-2-one Formula: C19H15F2N3O3 MolecularWeight: 371.337506

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1CN2C3=C(C=C(C=C3)[N+](=O)[O-])C(=NC(C2=O)F)C4=CC=CC=C4F

Isomeric SMILES

C1CC1CN2C3=C(C=C(C=C3)[N+](=O)[O-])C(=NC(C2=O)F)C4=CC=CC=C4F

InChI

InChI=1S/C19H15F2N3O3/c20-15-4-2-1-3-13(15)17-14-9-12(24(26)27)7-8-16(14)23(10-11-5-6-11)19(25)18(21)22-17/h1-4,7-9,11,18H,5-6,10H2