2-nitro-6-[(Z)-[(4-phenylazanyl-6-pyrrolidin-1-yl-1,3,5-triazin-2-yl)hydrazinylidene]methyl]phenolate

Systemtic Name: 2-nitro-6-[(Z)-[(4-phenylazanyl-6-pyrrolidin-1-yl-1,3,5-triazin-2-yl)hydrazinylidene]methyl]phenolate Openeye Name: 2-[(Z)-[(4-anilino-6-pyrrolidin-1-yl-1,3,5-triazin-2-yl)hydrazono]methyl]-6-nitro-phenolate CAS Name: 2-[(Z)-[[4-anilino-6-(1-pyrrolidinyl)-1,3,5-triazin-2-yl]hydrazinylidene]methyl]-6-nitrophenolate IUPAC Name: 2-[(Z)-[(4-anilino-6-pyrrolidin-1-yl-1,3,5-triazin-2-yl)hydrazinylidene]methyl]-6-nitrophenolate Traditional Name: 2-[(Z)-[(4-anilino-6-pyrrolidino-s-triazin-2-yl)hydrazono]methyl]-6-nitro-phenolate Formula: C20H19N8O3- MolecularWeight: 419.41666

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=NC(=NC(=N2)NN=CC3=C(C(=CC=C3)[N+](=O)[O-])[O-])NC4=CC=CC=C4

Isomeric SMILES

C1CCN(C1)C2=NC(=NC(=N2)N/N=C\C3=C(C(=CC=C3)[N+](=O)[O-])[O-])NC4=CC=CC=C4

InChI

InChI=1S/C20H20N8O3/c29-17-14(7-6-10-16(17)28(30)31)13-21-26-19-23-18(22-15-8-2-1-3-9-15)24-20(25-19)27-11-4-5-12-27/h1-3,6-10,13,29H,4-5,11-12H2,(H2,22,23,24,25,26)/p-1/b21-13-