1-(2-hydroxyethyl)-7-nitro-3-oxidanyl-5-phenyl-3H-1,4-benzodiazepin-2-one

Systemtic Name: 1-(2-hydroxyethyl)-7-nitro-3-oxidanyl-5-phenyl-3H-1,4-benzodiazepin-2-one Openeye Name: 3-hydroxy-1-(2-hydroxyethyl)-7-nitro-5-phenyl-3H-1,4-benzodiazepin-2-one CAS Name: 3-hydroxy-1-(2-hydroxyethyl)-7-nitro-5-phenyl-3H-1,4-benzodiazepin-2-one IUPAC Name: 3-hydroxy-1-(2-hydroxyethyl)-7-nitro-5-phenyl-3H-1,4-benzodiazepin-2-one Traditional Name: 3-hydroxy-1-(2-hydroxyethyl)-7-nitro-5-phenyl-3H-1,4-benzodiazepin-2-one Formula: C17H15N3O5 MolecularWeight: 341.3181

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(C(=O)N(C3=C2C=C(C=C3)[N+](=O)[O-])CCO)O

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(C(=O)N(C3=C2C=C(C=C3)[N+](=O)[O-])CCO)O

InChI

InChI=1S/C17H15N3O5/c21-9-8-19-14-7-6-12(20(24)25)10-13(14)15(18-16(22)17(19)23)11-4-2-1-3-5-11/h1-7,10,16,21-22H,8-9H2