3-(4-methoxyphenyl)-N-[3-[methyl-(phenylmethyl)amino]propyl]-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: 3-(4-methoxyphenyl)-N-[3-[methyl-(phenylmethyl)amino]propyl]-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: N-[3-[benzyl(methyl)amino]propyl]-3-(4-methoxyphenyl)-4-oxo-phthalazine-1-carboxamide CAS Name: 3-(4-methoxyphenyl)-N-[3-[methyl-(phenylmethyl)amino]propyl]-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-[3-[benzyl(methyl)amino]propyl]-3-(4-methoxyphenyl)-4-oxophthalazine-1-carboxamide Traditional Name: N-[3-[benzyl(methyl)amino]propyl]-4-keto-3-(4-methoxyphenyl)phthalazine-1-carboxamide Formula: C27H28N4O3 MolecularWeight: 456.53622

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCNC(=O)C1=NN(C(=O)C2=CC=CC=C21)C3=CC=C(C=C3)OC)CC4=CC=CC=C4

Isomeric SMILES

CN(CCCNC(=O)C1=NN(C(=O)C2=CC=CC=C21)C3=CC=C(C=C3)OC)CC4=CC=CC=C4

InChI

InChI=1S/C27H28N4O3/c1-30(19-20-9-4-3-5-10-20)18-8-17-28-26(32)25-23-11-6-7-12-24(23)27(33)31(29-25)21-13-15-22(34-2)16-14-21/h3-7,9-16H,8,17-19H2,1-2H3,(H,28,32)