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

Systemtic Name: methyl 2-[3-[(4-oxidanylidene-3H-phthalazin-1-yl)amino]propylcarbamoylamino]propanoate Openeye Name: methyl 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 methyl ester IUPAC Name: methyl 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 methyl ester Formula: C16H21N5O4 MolecularWeight: 347.36904

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H21N5O4/c1-10(15(23)25-2)19-16(24)18-9-5-8-17-13-11-6-3-4-7-12(11)14(22)21-20-13/h3-4,6-7,10H,5,8-9H2,1-2H3,(H,17,20)(H,21,22)(H2,18,19,24)