N-methyl-3-[[methyl-[(4-prop-2-enoxyphenyl)methyl]amino]methyl]-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: N-methyl-3-[[methyl-[(4-prop-2-enoxyphenyl)methyl]amino]methyl]-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: 3-[[(4-allyloxyphenyl)methyl-methyl-amino]methyl]-N-methyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-methyl-3-[[methyl-[(4-prop-2-enoxyphenyl)methyl]amino]methyl]-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-methyl-3-[[methyl-[(4-prop-2-enoxyphenyl)methyl]amino]methyl]-4-oxophthalazine-1-carboxamide Traditional Name: 3-[[(4-allyloxybenzyl)-methyl-amino]methyl]-4-keto-N-methyl-phthalazine-1-carboxamide Formula: C22H24N4O3 MolecularWeight: 392.45096

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=NN(C(=O)C2=CC=CC=C21)CN(C)CC3=CC=C(C=C3)OCC=C

Isomeric SMILES

CNC(=O)C1=NN(C(=O)C2=CC=CC=C21)CN(C)CC3=CC=C(C=C3)OCC=C

InChI

InChI=1S/C22H24N4O3/c1-4-13-29-17-11-9-16(10-12-17)14-25(3)15-26-22(28)19-8-6-5-7-18(19)20(24-26)21(27)23-2/h4-12H,1,13-15H2,2-3H3,(H,23,27)