(2R)-1-[(2R)-2-(4-oxidanylidene-1,2,3-benzotriazin-3-yl)-3-phenyl-propanoyl]pyrrolidine-2-carboxylate

Systemtic Name: (2R)-1-[(2R)-2-(4-oxidanylidene-1,2,3-benzotriazin-3-yl)-3-phenyl-propanoyl]pyrrolidine-2-carboxylate Openeye Name: (2R)-1-[(2R)-2-(4-oxo-1,2,3-benzotriazin-3-yl)-3-phenyl-propanoyl]pyrrolidine-2-carboxylate CAS Name: (2R)-1-[(2R)-1-oxo-2-(4-oxo-1,2,3-benzotriazin-3-yl)-3-phenylpropyl]-2-pyrrolidinecarboxylate IUPAC Name: (2R)-1-[(2R)-2-(4-oxo-1,2,3-benzotriazin-3-yl)-3-phenylpropanoyl]pyrrolidine-2-carboxylate Traditional Name: (2R)-1-[(2R)-2-(4-keto-1,2,3-benzotriazin-3-yl)-3-phenyl-propanoyl]pyrrolidine-2-carboxylate Formula: C21H19N4O4- MolecularWeight: 391.39996

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C(CC2=CC=CC=C2)N3C(=O)C4=CC=CC=C4N=N3)C(=O)[O-]

Isomeric SMILES

C1C[C@@H](N(C1)C(=O)[C@@H](CC2=CC=CC=C2)N3C(=O)C4=CC=CC=C4N=N3)C(=O)[O-]

InChI

InChI=1S/C21H20N4O4/c26-19-15-9-4-5-10-16(15)22-23-25(19)18(13-14-7-2-1-3-8-14)20(27)24-12-6-11-17(24)21(28)29/h1-5,7-10,17-18H,6,11-13H2,(H,28,29)/p-1/t17-,18-/m1/s1