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

Systemtic Name: 1-(cyclopropylmethyl)-3-fluoranyl-7-nitro-5-phenyl-3H-1,4-benzodiazepin-2-one Openeye Name: 1-(cyclopropylmethyl)-3-fluoro-7-nitro-5-phenyl-3H-1,4-benzodiazepin-2-one CAS Name: 1-(cyclopropylmethyl)-3-fluoro-7-nitro-5-phenyl-3H-1,4-benzodiazepin-2-one IUPAC Name: 1-(cyclopropylmethyl)-3-fluoro-7-nitro-5-phenyl-3H-1,4-benzodiazepin-2-one Traditional Name: 1-(cyclopropylmethyl)-3-fluoro-7-nitro-5-phenyl-3H-1,4-benzodiazepin-2-one Formula: C19H16FN3O3 MolecularWeight: 353.347043

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H16FN3O3/c20-18-19(24)22(11-12-6-7-12)16-9-8-14(23(25)26)10-15(16)17(21-18)13-4-2-1-3-5-13/h1-5,8-10,12,18H,6-7,11H2