3-(2-nitrophenyl)-2-oxidanylidene-N-[3-[(4-oxidanylidene-3H-phthalazin-1-yl)amino]propyl]propanamide

Systemtic Name: 3-(2-nitrophenyl)-2-oxidanylidene-N-[3-[(4-oxidanylidene-3H-phthalazin-1-yl)amino]propyl]propanamide Openeye Name: 3-(2-nitrophenyl)-2-oxo-N-[3-[(4-oxo-3H-phthalazin-1-yl)amino]propyl]propanamide CAS Name: 3-(2-nitrophenyl)-2-oxo-N-[3-[(4-oxo-3H-phthalazin-1-yl)amino]propyl]propanamide IUPAC Name: 3-(2-nitrophenyl)-2-oxo-N-[3-[(4-oxo-3H-phthalazin-1-yl)amino]propyl]propanamide Traditional Name: 2-keto-N-[3-[(4-keto-3H-phthalazin-1-yl)amino]propyl]-3-(2-nitrophenyl)propionamide Formula: C20H19N5O5 MolecularWeight: 409.39536

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CC(=O)C(=O)NCCCNC2=NNC(=O)C3=CC=CC=C32)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)CC(=O)C(=O)NCCCNC2=NNC(=O)C3=CC=CC=C32)[N+](=O)[O-]

InChI

InChI=1S/C20H19N5O5/c26-17(12-13-6-1-4-9-16(13)25(29)30)20(28)22-11-5-10-21-18-14-7-2-3-8-15(14)19(27)24-23-18/h1-4,6-9H,5,10-12H2,(H,21,23)(H,22,28)(H,24,27)