N-[2-[2-hydroxyethyl-(3-nitrophenyl)carbonyl-amino]ethyl]-3-nitro-benzamide

Systemtic Name: N-[2-[2-hydroxyethyl-(3-nitrophenyl)carbonyl-amino]ethyl]-3-nitro-benzamide Openeye Name: N-[2-[2-hydroxyethyl-(3-nitrobenzoyl)amino]ethyl]-3-nitro-benzamide CAS Name: N-[2-[2-hydroxyethyl-[(3-nitrophenyl)-oxomethyl]amino]ethyl]-3-nitrobenzamide IUPAC Name: N-[2-[2-hydroxyethyl-(3-nitrobenzoyl)amino]ethyl]-3-nitrobenzamide Traditional Name: N-[2-[2-hydroxyethyl-(3-nitrobenzoyl)amino]ethyl]-3-nitro-benzamide Formula: C18H18N4O7 MolecularWeight: 402.35812

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)NCCN(CCO)C(=O)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)NCCN(CCO)C(=O)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C18H18N4O7/c23-10-9-20(18(25)14-4-2-6-16(12-14)22(28)29)8-7-19-17(24)13-3-1-5-15(11-13)21(26)27/h1-6,11-12,23H,7-10H2,(H,19,24)