N'-[3-[(5-azanyl-5-oxidanylidene-pentanoyl)amino]-5-nitro-phenyl]pentanediamide

Systemtic Name: N'-[3-[(5-azanyl-5-oxidanylidene-pentanoyl)amino]-5-nitro-phenyl]pentanediamide Openeye Name: N'-[3-[(5-amino-5-oxo-pentanoyl)amino]-5-nitro-phenyl]pentanediamide CAS Name: N'-[3-[(5-amino-1,5-dioxopentyl)amino]-5-nitrophenyl]pentanediamide IUPAC Name: N'-[3-[(5-amino-5-oxopentanoyl)amino]-5-nitrophenyl]pentanediamide Traditional Name: N'-[3-[(5-amino-5-keto-pentanoyl)amino]-5-nitro-phenyl]glutaramide Formula: C16H21N5O6 MolecularWeight: 379.36784

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C=C1NC(=O)CCCC(=O)N)[N+](=O)[O-])NC(=O)CCCC(=O)N

Isomeric SMILES

C1=C(C=C(C=C1NC(=O)CCCC(=O)N)[N+](=O)[O-])NC(=O)CCCC(=O)N

InChI

InChI=1S/C16H21N5O6/c17-13(22)3-1-5-15(24)19-10-7-11(9-12(8-10)21(26)27)20-16(25)6-2-4-14(18)23/h7-9H,1-6H2,(H2,17,22)(H2,18,23)(H,19,24)(H,20,25)