N-[3-(3-methylphenoxy)propyl]-4-oxidanylidene-3H-phthalazine-1-carboxamide

Systemtic Name: N-[3-(3-methylphenoxy)propyl]-4-oxidanylidene-3H-phthalazine-1-carboxamide Openeye Name: N-[3-(3-methylphenoxy)propyl]-4-oxo-3H-phthalazine-1-carboxamide CAS Name: N-[3-(3-methylphenoxy)propyl]-4-oxo-3H-phthalazine-1-carboxamide IUPAC Name: N-[3-(3-methylphenoxy)propyl]-4-oxo-3H-phthalazine-1-carboxamide Traditional Name: 4-keto-N-[3-(3-methylphenoxy)propyl]-3H-phthalazine-1-carboxamide Formula: C19H19N3O3 MolecularWeight: 337.37246

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCCNC(=O)C2=NNC(=O)C3=CC=CC=C32

Isomeric SMILES

CC1=CC(=CC=C1)OCCCNC(=O)C2=NNC(=O)C3=CC=CC=C32

InChI

InChI=1S/C19H19N3O3/c1-13-6-4-7-14(12-13)25-11-5-10-20-19(24)17-15-8-2-3-9-16(15)18(23)22-21-17/h2-4,6-9,12H,5,10-11H2,1H3,(H,20,24)(H,22,23)