propyl 2-[3-[(4-oxidanylidene-3H-phthalazin-1-yl)amino]propylcarbamoylamino]propanoate

Systemtic Name: propyl 2-[3-[(4-oxidanylidene-3H-phthalazin-1-yl)amino]propylcarbamoylamino]propanoate Openeye Name: propyl 2-[3-[(4-oxo-3H-phthalazin-1-yl)amino]propylcarbamoylamino]propanoate CAS Name: 2-[[oxo-[3-[(4-oxo-3H-phthalazin-1-yl)amino]propylamino]methyl]amino]propanoic acid propyl ester IUPAC Name: propyl 2-[3-[(4-oxo-3H-phthalazin-1-yl)amino]propylcarbamoylamino]propanoate Traditional Name: 2-[3-[(4-keto-3H-phthalazin-1-yl)amino]propylcarbamoylamino]propionic acid propyl ester Formula: C18H25N5O4 MolecularWeight: 375.4222

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C(C)NC(=O)NCCCNC1=NNC(=O)C2=CC=CC=C21

Isomeric SMILES

CCCOC(=O)C(C)NC(=O)NCCCNC1=NNC(=O)C2=CC=CC=C21

InChI

InChI=1S/C18H25N5O4/c1-3-11-27-17(25)12(2)21-18(26)20-10-6-9-19-15-13-7-4-5-8-14(13)16(24)23-22-15/h4-5,7-8,12H,3,6,9-11H2,1-2H3,(H,19,22)(H,23,24)(H2,20,21,26)