methyl 3-(1H-indol-3-yl)-2-[(3-methyl-4-oxidanylidene-phthalazin-1-yl)carbonylamino]propanoate

Systemtic Name: methyl 3-(1H-indol-3-yl)-2-[(3-methyl-4-oxidanylidene-phthalazin-1-yl)carbonylamino]propanoate Openeye Name: methyl 3-(1H-indol-3-yl)-2-[(3-methyl-4-oxo-phthalazine-1-carbonyl)amino]propanoate CAS Name: 3-(1H-indol-3-yl)-2-[[(3-methyl-4-oxo-1-phthalazinyl)-oxomethyl]amino]propanoic acid methyl ester IUPAC Name: methyl 3-(1H-indol-3-yl)-2-[(3-methyl-4-oxophthalazine-1-carbonyl)amino]propanoate Traditional Name: 3-(1H-indol-3-yl)-2-[(4-keto-3-methyl-phthalazine-1-carbonyl)amino]propionic acid methyl ester Formula: C22H20N4O4 MolecularWeight: 404.4186

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC(CC3=CNC4=CC=CC=C43)C(=O)OC

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC(CC3=CNC4=CC=CC=C43)C(=O)OC

InChI

InChI=1S/C22H20N4O4/c1-26-21(28)16-9-4-3-8-15(16)19(25-26)20(27)24-18(22(29)30-2)11-13-12-23-17-10-6-5-7-14(13)17/h3-10,12,18,23H,11H2,1-2H3,(H,24,27)