2-(4-oxidanylidene-3H-phthalazin-1-yl)-N-[4-(4-phenylmethoxyphenoxy)butyl]ethanamide

Systemtic Name: 2-(4-oxidanylidene-3H-phthalazin-1-yl)-N-[4-(4-phenylmethoxyphenoxy)butyl]ethanamide Openeye Name: N-[4-(4-benzyloxyphenoxy)butyl]-2-(4-oxo-3H-phthalazin-1-yl)acetamide CAS Name: 2-(4-oxo-3H-phthalazin-1-yl)-N-[4-(4-phenylmethoxyphenoxy)butyl]acetamide IUPAC Name: 2-(4-oxo-3H-phthalazin-1-yl)-N-[4-(4-phenylmethoxyphenoxy)butyl]acetamide Traditional Name: N-[4-(4-benzoxyphenoxy)butyl]-2-(4-keto-3H-phthalazin-1-yl)acetamide Formula: C27H27N3O4 MolecularWeight: 457.52098

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=C(C=C2)OCCCCNC(=O)CC3=NNC(=O)C4=CC=CC=C43

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=C(C=C2)OCCCCNC(=O)CC3=NNC(=O)C4=CC=CC=C43

InChI

InChI=1S/C27H27N3O4/c31-26(18-25-23-10-4-5-11-24(23)27(32)30-29-25)28-16-6-7-17-33-21-12-14-22(15-13-21)34-19-20-8-2-1-3-9-20/h1-5,8-15H,6-7,16-19H2,(H,28,31)(H,30,32)