4-oxidanylidene-N-[2-(4-propan-2-yloxyphenyl)ethyl]-3H-phthalazine-1-carboxamide

Systemtic Name: 4-oxidanylidene-N-[2-(4-propan-2-yloxyphenyl)ethyl]-3H-phthalazine-1-carboxamide Openeye Name: N-[2-(4-isopropoxyphenyl)ethyl]-4-oxo-3H-phthalazine-1-carboxamide CAS Name: 4-oxo-N-[2-(4-propan-2-yloxyphenyl)ethyl]-3H-phthalazine-1-carboxamide IUPAC Name: 4-oxo-N-[2-(4-propan-2-yloxyphenyl)ethyl]-3H-phthalazine-1-carboxamide Traditional Name: N-[2-(4-isopropoxyphenyl)ethyl]-4-keto-3H-phthalazine-1-carboxamide Formula: C20H21N3O3 MolecularWeight: 351.39904

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)CCNC(=O)C2=NNC(=O)C3=CC=CC=C32

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)CCNC(=O)C2=NNC(=O)C3=CC=CC=C32

InChI

InChI=1S/C20H21N3O3/c1-13(2)26-15-9-7-14(8-10-15)11-12-21-20(25)18-16-5-3-4-6-17(16)19(24)23-22-18/h3-10,13H,11-12H2,1-2H3,(H,21,25)(H,23,24)