[3-nitro-4-[[(2S)-2-(4-nitrophenyl)-2-oxidanyl-ethyl]amino]phenyl]-phenyl-methanone

Systemtic Name: [3-nitro-4-[[(2S)-2-(4-nitrophenyl)-2-oxidanyl-ethyl]amino]phenyl]-phenyl-methanone Openeye Name: [4-[[(2S)-2-hydroxy-2-(4-nitrophenyl)ethyl]amino]-3-nitro-phenyl]-phenyl-methanone CAS Name: [4-[[(2S)-2-hydroxy-2-(4-nitrophenyl)ethyl]amino]-3-nitrophenyl]-phenylmethanone IUPAC Name: [4-[[(2S)-2-hydroxy-2-(4-nitrophenyl)ethyl]amino]-3-nitrophenyl]-phenylmethanone Traditional Name: [4-[[(2S)-2-hydroxy-2-(4-nitrophenyl)ethyl]amino]-3-nitro-phenyl]-phenyl-methanone Formula: C21H17N3O6 MolecularWeight: 407.37618

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C2=CC(=C(C=C2)NCC(C3=CC=C(C=C3)[N+](=O)[O-])O)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C2=CC(=C(C=C2)NC[C@H](C3=CC=C(C=C3)[N+](=O)[O-])O)[N+](=O)[O-]

InChI

InChI=1S/C21H17N3O6/c25-20(14-6-9-17(10-7-14)23(27)28)13-22-18-11-8-16(12-19(18)24(29)30)21(26)15-4-2-1-3-5-15/h1-12,20,22,25H,13H2/t20-/m1/s1