N-[3-(3-nitrophenyl)-1,2,4-oxadiazol-5-yl]-N-[4-[(4-oxidanylidene-3H-phthalazin-1-yl)amino]butyl]propanamide

Systemtic Name: N-[3-(3-nitrophenyl)-1,2,4-oxadiazol-5-yl]-N-[4-[(4-oxidanylidene-3H-phthalazin-1-yl)amino]butyl]propanamide Openeye Name: N-[3-(3-nitrophenyl)-1,2,4-oxadiazol-5-yl]-N-[4-[(4-oxo-3H-phthalazin-1-yl)amino]butyl]propanamide CAS Name: N-[3-(3-nitrophenyl)-1,2,4-oxadiazol-5-yl]-N-[4-[(4-oxo-3H-phthalazin-1-yl)amino]butyl]propanamide IUPAC Name: N-[3-(3-nitrophenyl)-1,2,4-oxadiazol-5-yl]-N-[4-[(4-oxo-3H-phthalazin-1-yl)amino]butyl]propanamide Traditional Name: N-[4-[(4-keto-3H-phthalazin-1-yl)amino]butyl]-N-[3-(3-nitrophenyl)-1,2,4-oxadiazol-5-yl]propionamide Formula: C23H23N7O5 MolecularWeight: 477.47262

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N(CCCCNC1=NNC(=O)C2=CC=CC=C21)C3=NC(=NO3)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CCC(=O)N(CCCCNC1=NNC(=O)C2=CC=CC=C21)C3=NC(=NO3)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C23H23N7O5/c1-2-19(31)29(23-25-20(28-35-23)15-8-7-9-16(14-15)30(33)34)13-6-5-12-24-21-17-10-3-4-11-18(17)22(32)27-26-21/h3-4,7-11,14H,2,5-6,12-13H2,1H3,(H,24,26)(H,27,32)