N-[(4-ethoxy-3-methoxy-phenyl)methyl]-N-methyl-4-oxidanylidene-3-(phenylmethyl)phthalazine-1-carboxamide

Systemtic Name: N-[(4-ethoxy-3-methoxy-phenyl)methyl]-N-methyl-4-oxidanylidene-3-(phenylmethyl)phthalazine-1-carboxamide Openeye Name: 3-benzyl-N-[(4-ethoxy-3-methoxy-phenyl)methyl]-N-methyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-[(4-ethoxy-3-methoxyphenyl)methyl]-N-methyl-4-oxo-3-(phenylmethyl)-1-phthalazinecarboxamide IUPAC Name: 3-benzyl-N-[(4-ethoxy-3-methoxyphenyl)methyl]-N-methyl-4-oxophthalazine-1-carboxamide Traditional Name: 3-benzyl-N-(4-ethoxy-3-methoxy-benzyl)-4-keto-N-methyl-phthalazine-1-carboxamide Formula: C27H27N3O4 MolecularWeight: 457.52098

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CN(C)C(=O)C2=NN(C(=O)C3=CC=CC=C32)CC4=CC=CC=C4)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CN(C)C(=O)C2=NN(C(=O)C3=CC=CC=C32)CC4=CC=CC=C4)OC

InChI

InChI=1S/C27H27N3O4/c1-4-34-23-15-14-20(16-24(23)33-3)17-29(2)27(32)25-21-12-8-9-13-22(21)26(31)30(28-25)18-19-10-6-5-7-11-19/h5-16H,4,17-18H2,1-3H3