N-[4-(4-chloranylphenoxy)butyl]-4-oxidanylidene-3H-phthalazine-1-carboxamide

Systemtic Name: N-[4-(4-chloranylphenoxy)butyl]-4-oxidanylidene-3H-phthalazine-1-carboxamide Openeye Name: N-[4-(4-chlorophenoxy)butyl]-4-oxo-3H-phthalazine-1-carboxamide CAS Name: N-[4-(4-chlorophenoxy)butyl]-4-oxo-3H-phthalazine-1-carboxamide IUPAC Name: N-[4-(4-chlorophenoxy)butyl]-4-oxo-3H-phthalazine-1-carboxamide Traditional Name: N-[4-(4-chlorophenoxy)butyl]-4-keto-3H-phthalazine-1-carboxamide Formula: C19H18ClN3O3 MolecularWeight: 371.81752

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NNC2=O)C(=O)NCCCCOC3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=NNC2=O)C(=O)NCCCCOC3=CC=C(C=C3)Cl

InChI

InChI=1S/C19H18ClN3O3/c20-13-7-9-14(10-8-13)26-12-4-3-11-21-19(25)17-15-5-1-2-6-16(15)18(24)23-22-17/h1-2,5-10H,3-4,11-12H2,(H,21,25)(H,23,24)