methyl 4-(1H-benzimidazol-2-ylmethylamino)phthalazine-1-carboxylate

Systemtic Name: methyl 4-(1H-benzimidazol-2-ylmethylamino)phthalazine-1-carboxylate Openeye Name: methyl 4-(1H-benzimidazol-2-ylmethylamino)phthalazine-1-carboxylate CAS Name: 4-(1H-benzimidazol-2-ylmethylamino)-1-phthalazinecarboxylic acid methyl ester IUPAC Name: methyl 4-(1H-benzimidazol-2-ylmethylamino)phthalazine-1-carboxylate Traditional Name: 4-(1H-benzimidazol-2-ylmethylamino)phthalazine-1-carboxylic acid methyl ester Formula: C18H15N5O2 MolecularWeight: 333.344

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=NN=C(C2=CC=CC=C21)NCC3=NC4=CC=CC=C4N3

Isomeric SMILES

COC(=O)C1=NN=C(C2=CC=CC=C21)NCC3=NC4=CC=CC=C4N3

InChI

InChI=1S/C18H15N5O2/c1-25-18(24)16-11-6-2-3-7-12(11)17(23-22-16)19-10-15-20-13-8-4-5-9-14(13)21-15/h2-9H,10H2,1H3,(H,19,23)(H,20,21)