N-[2-[(4-hydroxyphenyl)carbonylamino]ethyl]-3-nitro-4,5-bis(oxidanyl)benzamide

Systemtic Name: N-[2-[(4-hydroxyphenyl)carbonylamino]ethyl]-3-nitro-4,5-bis(oxidanyl)benzamide Openeye Name: 3,4-dihydroxy-N-[2-[(4-hydroxybenzoyl)amino]ethyl]-5-nitro-benzamide CAS Name: 3,4-dihydroxy-N-[2-[[(4-hydroxyphenyl)-oxomethyl]amino]ethyl]-5-nitrobenzamide IUPAC Name: 3,4-dihydroxy-N-[2-[(4-hydroxybenzoyl)amino]ethyl]-5-nitrobenzamide Traditional Name: 3,4-dihydroxy-N-[2-[(4-hydroxybenzoyl)amino]ethyl]-5-nitro-benzamide Formula: C16H15N3O7 MolecularWeight: 361.3062

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)NCCNC(=O)C2=CC(=C(C(=C2)O)O)[N+](=O)[O-])O

Isomeric SMILES

C1=CC(=CC=C1C(=O)NCCNC(=O)C2=CC(=C(C(=C2)O)O)[N+](=O)[O-])O

InChI

InChI=1S/C16H15N3O7/c20-11-3-1-9(2-4-11)15(23)17-5-6-18-16(24)10-7-12(19(25)26)14(22)13(21)8-10/h1-4,7-8,20-22H,5-6H2,(H,17,23)(H,18,24)